N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G858-0299 |
| Compound Name: | N-(2-methoxyethyl)-3-(3-methoxyphenyl)-2-{[(4-nitrophenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 520.56 |
| Molecular Formula: | C26 H24 N4 O6 S |
| Smiles: | COCCNC(c1ccc2C(N(C(=Nc2c1)SCc1ccc(cc1)[N+]([O-])=O)c1cccc(c1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2991 |
| logD: | 3.299 |
| logSw: | -3.7593 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.954 |
| InChI Key: | YGPHYCUHEDREQA-UHFFFAOYSA-N |