3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2,3-dimethylcyclohexyl)benzamide
Chemical Structure Depiction of
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2,3-dimethylcyclohexyl)benzamide
3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2,3-dimethylcyclohexyl)benzamide
Compound characteristics
| Compound ID: | K288-0605 |
| Compound Name: | 3-(7-chloro-4-oxo-2-sulfanylidene-1,4-dihydroquinazolin-3(2H)-yl)-N-(2,3-dimethylcyclohexyl)benzamide |
| Molecular Weight: | 441.98 |
| Molecular Formula: | C23 H24 Cl N3 O2 S |
| Smiles: | CC1CCCC(C1C)NC(c1cccc(c1)N1C(c2ccc(cc2NC1=S)[Cl])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.399 |
| logD: | 4.0217 |
| logSw: | -4.5942 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.235 |
| InChI Key: | OHPBGKCMMZDNTR-UHFFFAOYSA-N |