(4-benzylpiperazin-1-yl)[4-(3-chlorobenzene-1-sulfonyl)-3-nitrophenyl]methanone
Chemical Structure Depiction of
(4-benzylpiperazin-1-yl)[4-(3-chlorobenzene-1-sulfonyl)-3-nitrophenyl]methanone
(4-benzylpiperazin-1-yl)[4-(3-chlorobenzene-1-sulfonyl)-3-nitrophenyl]methanone
Compound characteristics
| Compound ID: | K781-2535 |
| Compound Name: | (4-benzylpiperazin-1-yl)[4-(3-chlorobenzene-1-sulfonyl)-3-nitrophenyl]methanone |
| Molecular Weight: | 499.97 |
| Molecular Formula: | C24 H22 Cl N3 O5 S |
| Smiles: | C1CN(CCN1Cc1ccccc1)C(c1ccc(c(c1)[N+]([O-])=O)S(c1cccc(c1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6677 |
| logD: | 3.6523 |
| logSw: | -4.1058 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.009 |
| InChI Key: | KTPBMRRITWYSQL-UHFFFAOYSA-N |