ChemDiv1_013645
N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]propanamide
Also Known As: ChemDiv1_013645|Oprea1_295622|HMS625M05|SR-01000558937-1|F3407-3898|N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-({[(3-methoxyphenyl)carbamoyl]methyl}sulfanyl)-4-oxo-3,4-dihydroquinazolin-3-yl]propanamide|N-(3,4-dimethoxyphenethyl)-3-(2-((2-((3-methoxyphenyl)amino)-2-oxoethyl)thio)-4-oxoquinazolin-3(4H)-yl)propanamide|N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]propanamide
| Molecular Formula | C30H32N4O6S |
|---|---|
| Molecular Weight | 576.2043 g/mol |
| LogP | 3.9021 |
| Topological Polar Surface Area | 120.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 13 |
| Exact Mass | 576.2043 |
| Monoisotopic Mass | 576.2043 |
| Heavy Atoms | 41 |
| Complexity | 1589.2985 |
Chemical Identifiers
| CAS Number | 422286-91-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)CCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NC4=CC(=CC=C4)OC)OC |
Product Overview
ChemDiv1_013645 (CAS 422286-91-7), with molecular formula C30H32N4O6S and molecular weight 576.2043 g/mol. IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-3-[2-[2-(3-methoxyanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]propanamide.
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