5S-(((5-Thiazolyl)methoxy)carbonyl)amino-2-((N-2-isopropyl-4-oxazolyl)methoxycarbonyl)amino-4S-hydroxy-1,6-diphenyl-2-azahexane
Basic information
- CAS
162739-41-5- Standard SMILES
CC(C)c1nc(COC(=O)NN(Cc2ccccc2)C[C@H](O)[C@H](Cc2ccccc2)NC(=O)OCc2cncs2)co1- InChIKey
AOMIJEFWYSGOPW-SVBPBHIXSA-N- Molecular formula
- C30H35N5O6S
- Average molar mass
- 593.7 g/mol
- Monoisotopic mass
- 593.23080503
Names & identifiers
- Preferred name
- 5S-(((5-Thiazolyl)methoxy)carbonyl)amino-2-((N-2-isopropyl-4-oxazolyl)methoxycarbonyl)amino-4S-hydroxy-1,6-diphenyl-2-azahexane
- IUPAC
- (2-propan-2-yl-1,3-oxazol-4-yl)methyl N-[benzyl-[(2S,3S)-2-hydroxy-4-phenyl-3-(1,3-thiazol-5-ylmethoxycarbonylamino)butyl]amino]carbamate
Names & synonyms
162739-41-55S-(((5-Thiazolyl)methoxy)carbonyl)amino-2-((N-2-isopropyl-4-oxazolyl)methoxycarbonyl)amino-4S-hydroxy-1,6-diphenyl-2-azahexaneSCHEMBL7336856DTXSID70167457[2-(Propan-2-yl)-1,3-oxazol-4-yl]methyl 2-benzyl-2-[(2S,3S)-2-hydroxy-4-phenyl-3-({[(1,3-thiazol-5-yl)methoxy]carbonyl}amino)butyl]hydrazine-1-carboxylatethiazol-5-ylmethyl N-[(1S,2S)-1-benzyl-3-[benzyl-[(2-isopropyloxazol-4-yl)methoxycarbonylamino]amino]-2-hydroxy-propyl]carbamate
Database identifiers
- CAS
162739-41-5- PubChem CID
- 475592
- DTXSID
DTXSID70167457
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 167 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 16
- Heavy atoms
- 42
- Formal charge
- 0
- Complexity
- 813
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Compound notes
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