N-(3-methylbutyl)-4-{[4-oxo-2-({2-oxo-2-[(propan-2-yl)amino]ethyl}sulfanyl)quinazolin-3(4H)-yl]methyl}benzamide
Chemical Structure Depiction of
N-(3-methylbutyl)-4-{[4-oxo-2-({2-oxo-2-[(propan-2-yl)amino]ethyl}sulfanyl)quinazolin-3(4H)-yl]methyl}benzamide
N-(3-methylbutyl)-4-{[4-oxo-2-({2-oxo-2-[(propan-2-yl)amino]ethyl}sulfanyl)quinazolin-3(4H)-yl]methyl}benzamide
Compound characteristics
| Compound ID: | G629-0240 |
| Compound Name: | N-(3-methylbutyl)-4-{[4-oxo-2-({2-oxo-2-[(propan-2-yl)amino]ethyl}sulfanyl)quinazolin-3(4H)-yl]methyl}benzamide |
| Molecular Weight: | 480.63 |
| Molecular Formula: | C26 H32 N4 O3 S |
| Smiles: | CC(C)CCNC(c1ccc(CN2C(=Nc3ccccc3C2=O)SCC(NC(C)C)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4485 |
| logD: | 3.4485 |
| logSw: | -3.9161 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.015 |
| InChI Key: | CVYYNLDECGZTKO-UHFFFAOYSA-N |