Oprea1_276118
N-[(3-chlorophenyl)methyl]-4-[2-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide
Also Known As: Oprea1_276118|SR-01000558546-1|F0916-5054|N-[(3-chlorophenyl)methyl]-4-(2-{[(cyclohexylcarbamoyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazolin-3-yl)butanamide|N-(3-chlorobenzyl)-4-(2-((2-(cyclohexylamino)-2-oxoethyl)thio)-4-oxoquinazolin-3(4H)-yl)butanamide|N-[(3-chlorophenyl)methyl]-4-[2-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide
| Molecular Formula | C27H31ClN4O3S |
|---|---|
| Molecular Weight | 526.18054 g/mol |
| LogP | 4.6875 |
| Topological Polar Surface Area | 93.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 526.18054 |
| Monoisotopic Mass | 526.18054 |
| Heavy Atoms | 36 |
| Complexity | 1273.3536 |
Chemical Identifiers
| CAS Number | 422282-30-2 |
|---|---|
| SMILES | C1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)NCC4=CC(=CC=C4)Cl |
Product Overview
Oprea1_276118 (CAS 422282-30-2), with molecular formula C27H31ClN4O3S and molecular weight 526.18054 g/mol. IUPAC: N-[(3-chlorophenyl)methyl]-4-[2-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide.
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