1-(4-methoxyphenyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
Chemical Structure Depiction of
1-(4-methoxyphenyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
1-(4-methoxyphenyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione
Compound characteristics
| Compound ID: | 5769-0197 |
| Compound Name: | 1-(4-methoxyphenyl)-2-(3-nitrophenyl)-5,6,7,8-tetrahydroquinazoline-4(1H)-thione |
| Molecular Weight: | 393.46 |
| Molecular Formula: | C21 H19 N3 O3 S |
| Smiles: | COc1ccc(cc1)N1C2CCCCC=2C(N=C1c1cccc(c1)[N+]([O-])=O)=S |
| Stereo: | ACHIRAL |
| logP: | 4.6234 |
| logD: | 4.5909 |
| logSw: | -4.5136 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.922 |
| InChI Key: | ZACAZBWMAVVRIC-UHFFFAOYSA-N |