10-chloro-11-hydroxy-4,8-diphenyl-3,4,4a,5,6,7,7a,8-octahydro[1]benzopyrano[3,2-i]quinazoline-2(1H)-thione
Chemical Structure Depiction of
10-chloro-11-hydroxy-4,8-diphenyl-3,4,4a,5,6,7,7a,8-octahydro[1]benzopyrano[3,2-i]quinazoline-2(1H)-thione
10-chloro-11-hydroxy-4,8-diphenyl-3,4,4a,5,6,7,7a,8-octahydro[1]benzopyrano[3,2-i]quinazoline-2(1H)-thione
Compound characteristics
| Compound ID: | 8015-0456 |
| Compound Name: | 10-chloro-11-hydroxy-4,8-diphenyl-3,4,4a,5,6,7,7a,8-octahydro[1]benzopyrano[3,2-i]quinazoline-2(1H)-thione |
| Molecular Weight: | 477.02 |
| Molecular Formula: | C27 H25 Cl N2 O2 S |
| Smiles: | C1CC2C(c3ccccc3)c3cc(c(cc3OC23C(C1)C(c1ccccc1)NC(N3)=S)O)[Cl] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.5638 |
| logD: | 6.5198 |
| logSw: | -5.9784 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 48.317 |
| InChI Key: | OJVFCCKMQFSLLN-UHFFFAOYSA-N |