2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Chemical Structure Depiction of
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one
Compound characteristics
| Compound ID: | G856-0876 |
| Compound Name: | 2-{[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl}-3-phenyl-3,5-dihydro-4H-pyrimido[5,4-b]indol-4-one |
| Molecular Weight: | 445.93 |
| Molecular Formula: | C24 H16 Cl N3 O2 S |
| Smiles: | C(C(c1ccc(cc1)[Cl])=O)SC1=Nc2c3ccccc3[nH]c2C(N1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6483 |
| logD: | 4.6483 |
| logSw: | -5.0711 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.365 |
| InChI Key: | LVQJTRWXDWTTNG-UHFFFAOYSA-N |