2-[(cyanomethyl)sulfanyl]-N-cyclopentyl-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-[(cyanomethyl)sulfanyl]-N-cyclopentyl-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-[(cyanomethyl)sulfanyl]-N-cyclopentyl-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G858-0325 |
| Compound Name: | 2-[(cyanomethyl)sulfanyl]-N-cyclopentyl-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 434.52 |
| Molecular Formula: | C23 H22 N4 O3 S |
| Smiles: | COc1cccc(c1)N1C(=Nc2cc(ccc2C1=O)C(NC1CCCC1)=O)SCC#N |
| Stereo: | ACHIRAL |
| logP: | 3.0219 |
| logD: | 3.0219 |
| logSw: | -3.5825 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.971 |
| InChI Key: | SBURWMSNSSGPNB-UHFFFAOYSA-N |