(2'S,3R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluorophenyl)-2'-(2,2-dimethylpropyl)-2-oxo-N-[(1r,4r)-4-hydroxycyclohexyl]-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxamide

Compound number:
MolPort-035-944-342
CAS number: 1303607-60-4
IUPAC:
(2'S,3R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluorophenyl)-2'-(2,2-dimethylpropyl)-2-oxo-N-[(1r,4r)-4-hydroxycyclohexyl]-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxamide
IUPAC traditional:
(2'S,3R,4'S,5'R)-6-chloro-4'-(3-chloro-2-fluorophenyl)-2'-(2,2-dimethylpropyl)-2-oxo-N-[(1r,4r)-4-hydroxycyclohexyl]-1H-spiro[indole-3,3'-pyrrolidine]-5'-carboxamide
SMILES:
CC(C)(C)C[C@@H]1N[C@H]([C@H](c2cccc(Cl)c2F)[C@]11C(=O)Nc2cc(Cl)ccc12)C(=O)N[C@H]1CC[C@H](O)CC1 |r,wU:31.34,8.8,5.4,wD:7.31,34.38,17.29,(11.22,.14,;10.13,1.23,;10.53,2.71,;11.61,1.62,;8.65,.83,;7.56,1.92,;8.42,3.19,;7.48,4.41,;6.03,3.89,;4.14,5.09,;2.81,4.32,;1.48,5.09,;1.48,6.63,;2.81,7.4,;2.81,8.93,;4.14,6.63,;5.47,7.39,;6.08,2.35,;6.51,.87,;7.96,.35,;5.24,,;4.02,.94,;2.51,.67,;1.51,1.84,;,1.57,;2.03,3.29,;3.54,3.57,;4.54,2.39,;7.91,5.89,;6.84,7,;9.4,6.26,;10.73,6.17,;11.5,7.51,;13.04,7.52,;13.81,6.19,;15.35,6.2,;13.05,4.85,;11.51,4.84,)|
InChI key:
IDKAKZRYYDCJDU-HBMMIIHUSA-N
Molecular formula:
C29H34Cl2FN3O3
Molecular weight: 562.51
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Supplier Catalogue Data


Catalog: Screening compound Ships out: 2 business days Purity: 98.0
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5 mg October 22, 2019 147.50 USD
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Catalog: Screening compound Ships out: 7 business days Purity: n/a
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5 mg October 29, 2019 161.66 USD
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10 mg October 29, 2019 271.40 USD
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50 mg October 29, 2019 1044.30 USD
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Catalog: Screening compound Ships out: 7 business days Purity: n/a
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5 mg October 29, 2019 231.60 USD
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25 mg October 29, 2019 939.60 USD
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More Information

Compound Identifiers
Compound number: MolPort-035-944-342
CAS number: 1303607-60-4

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000101676696
ZINC000145424989
(2'S,3R,4'S,5'R)-6-Chloro-4'-(3-chloro-2-fluorophenyl)-N-((1r,4R)-4-hydroxycyclohexyl)-2'-neopentyl-2-oxospiro[indoline-3,3'-pyrrolidine]-5'-carboxamide
MI-773
MI-773 (SAR405838)
MI-77301
SAR405838
Spiro[3H-indole-3,3'-pyrrolidine]-5'-carboxamide,6-chloro-4'-(3-chloro-2-fluorophenyl)-2'-(2,2-dimethylpropyl)-1,2-dihydro-N-(trans-4-hydroxycyclohexyl)-2-oxo-, (2'S,3R,4'S,5'R)-

InChI
InChI: 1S/C29H34Cl2FN3O3/c1-28(2,3)14-22-29(19-12-7-15(30)13-21(19)34-27(29)38)23(18-5-4-6-20(31)24(18)32)25(35-22)26(37)33-16-8-10-17(36)11-9-16/h4-7,12-13,16-17,22-23,25,35-36H,8-11,14H2,1-3H3,(H,33,37)(H,34,38)/t16-,17-,22-,23-,25+,29+/m0/s1
InChI key: IDKAKZRYYDCJDU-HBMMIIHUSA-N

Calculated Properties
Molecular formula: C29H34Cl2FN3O3
Molecular weight: 562.51

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2019 MolPort, v3.22, release date 14-10-2019 15:00 (+0200). All rights reserved.
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