2-(3-nitrophenyl)-1-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
Chemical Structure Depiction of
2-(3-nitrophenyl)-1-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
2-(3-nitrophenyl)-1-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
Compound characteristics
| Compound ID: | 5055-9126 |
| Compound Name: | 2-(3-nitrophenyl)-1-phenyl-5,6,7,8-tetrahydroquinazoline-4(1H)-thione |
| Molecular Weight: | 363.44 |
| Molecular Formula: | C20 H17 N3 O2 S |
| Smiles: | C1CCC2=C(C1)C(N=C(c1cccc(c1)[N+]([O-])=O)N2c1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 4.5194 |
| logD: | 4.4869 |
| logSw: | -4.493 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 45.378 |
| InChI Key: | VCDWWMIEEYAGJT-UHFFFAOYSA-N |