3-(4-chlorophenyl)-2-{1-[4-(4-fluorobenzene-1-sulfonyl)-3-methylpiperazin-1-yl]ethyl}quinazolin-4(3H)-one
Chemical Structure Depiction of
3-(4-chlorophenyl)-2-{1-[4-(4-fluorobenzene-1-sulfonyl)-3-methylpiperazin-1-yl]ethyl}quinazolin-4(3H)-one
3-(4-chlorophenyl)-2-{1-[4-(4-fluorobenzene-1-sulfonyl)-3-methylpiperazin-1-yl]ethyl}quinazolin-4(3H)-one
Compound characteristics
| Compound ID: | V003-6142 |
| Compound Name: | 3-(4-chlorophenyl)-2-{1-[4-(4-fluorobenzene-1-sulfonyl)-3-methylpiperazin-1-yl]ethyl}quinazolin-4(3H)-one |
| Molecular Weight: | 541.04 |
| Molecular Formula: | C27 H26 Cl F N4 O3 S |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1S(c1ccc(cc1)F)(=O)=O)C(C)C1=Nc2ccccc2C(N1c1ccc(cc1)[Cl])=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.9301 |
| logD: | 3.9287 |
| logSw: | -4.4558 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.929 |
| InChI Key: | VFZCGTMHQIXLSI-UHFFFAOYSA-N |