N,N-diethyl-3-(4-fluorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Chemical Structure Depiction of
N,N-diethyl-3-(4-fluorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
N,N-diethyl-3-(4-fluorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide
Compound characteristics
| Compound ID: | G858-0539 |
| Compound Name: | N,N-diethyl-3-(4-fluorophenyl)-2-{[(3-methoxyphenyl)methyl]sulfanyl}-4-oxo-3,4-dihydroquinazoline-7-carboxamide |
| Molecular Weight: | 491.58 |
| Molecular Formula: | C27 H26 F N3 O3 S |
| Smiles: | CCN(CC)C(c1ccc2C(N(C(=Nc2c1)SCc1cccc(c1)OC)c1ccc(cc1)F)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0605 |
| logD: | 4.0602 |
| logSw: | -4.2265 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.635 |
| InChI Key: | YXOYABOEGXIWJX-UHFFFAOYSA-N |