5-chloro-2-[(5R)-5-methyl-4-[5-methyl-2-(2H-1,2,3-triazol-2-yl)benzoyl]-1,4-diazepan-1-yl]-1,3-benzoxazole

Compound number:
MolPort-023-219-189
CAS number: 1030377-33-3
IUPAC:
5-chloro-2-[(5R)-5-methyl-4-[5-methyl-2-(2H-1,2,3-triazol-2-yl)benzoyl]-1,4-diazepan-1-yl]-1,3-benzoxazole
IUPAC traditional:
suvorexant
SMILES:
C[C@@H]1CCN(CCN1C(=O)c1cc(C)ccc1-n1nccn1)c1nc2cc(Cl)ccc2o1 |r|
InChI key:
JYTNQNCOQXFQPK-MRXNPFEDSA-N
Molecular formula:
C23H23ClN6O2
Molecular weight: 450.93
Solubility: not available

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Supplier Catalogue Data


Catalog: Building blocks Ships out: 10 business days Purity: 98%
Last updated: last month In warehouse: 1000.00 mg
Pack size Ships out Price Qty
5 mg March 4, 2020 92.00 USD
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25 mg March 4, 2020 303.00 USD
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100 mg March 4, 2020 953.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-023-219-189
CAS number: 1030377-33-3

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000049036447
MFCD22377755
5-chloro-2-[(5R)-5-methyl-4-[5-methyl-2-(1,2,3-triazol-2-yl)benzoyl]-1,4-diazepan-1-yl]-1,3-benzoxazole
5-Chloro-2-[(5R)-5-methyl-4-[5-methyl-2-(2H-1,2,3-triazol-2-yl)benzoyl]-1,4-diazepan-1-yl]-1,3-benzoxazole
MK-4305
(R)-(4-(5-Chlorobenzo[d]oxazol-2-yl)-7-methyl-1,4-diazepan-1-yl)(5-methyl-2-(2H-1,2,3-triazol-2-yl)phenyl)methanone
Suvorexant
Suvorexant(MK-4305)

InChI
InChI: 1S/C23H23ClN6O2/c1-15-3-5-20(30-25-8-9-26-30)18(13-15)22(31)29-12-11-28(10-7-16(29)2)23-27-19-14-17(24)4-6-21(19)32-23/h3-6,8-9,13-14,16H,7,10-12H2,1-2H3/t16-/m1/s1
InChI key: JYTNQNCOQXFQPK-MRXNPFEDSA-N

Calculated Properties
Molecular formula: C23H23ClN6O2
Molecular weight: 450.93

Other

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2020 MolPort, v3.4, release date 13-02-2020 13:00 (+0200). All rights reserved.
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