7-chloro-3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Chemical Structure Depiction of
7-chloro-3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
7-chloro-3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one
Compound characteristics
| Compound ID: | K287-0341 |
| Compound Name: | 7-chloro-3-(3-methoxyphenyl)-2-sulfanylidene-2,3-dihydroquinazolin-4(1H)-one |
| Molecular Weight: | 318.78 |
| Molecular Formula: | C15 H11 Cl N2 O2 S |
| Smiles: | COc1cccc(c1)N1C(c2ccc(cc2NC1=S)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5266 |
| logD: | 3.3488 |
| logSw: | -3.9936 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.25 |
| InChI Key: | BLAKXPYXHDCOSX-UHFFFAOYSA-N |