2-{[(3-chlorophenyl)methyl]sulfanyl}-N,N-diethyl-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
2-{[(3-chlorophenyl)methyl]sulfanyl}-N,N-diethyl-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
2-{[(3-chlorophenyl)methyl]sulfanyl}-N,N-diethyl-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G859-0358 |
| Compound Name: | 2-{[(3-chlorophenyl)methyl]sulfanyl}-N,N-diethyl-3-(3-methoxyphenyl)-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 508.04 |
| Molecular Formula: | C27 H26 Cl N3 O3 S |
| Smiles: | CCN(CC)C(c1ccc2C(N(C(=Nc2c1)SCc1cccc(c1)[Cl])c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7953 |
| logD: | 4.7952 |
| logSw: | -4.8971 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.635 |
| InChI Key: | FWTBOIQYTHTHOM-UHFFFAOYSA-N |