2-chloro-3-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]naphthalene-1,4-dione
Chemical Structure Depiction of
2-chloro-3-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]naphthalene-1,4-dione
2-chloro-3-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]naphthalene-1,4-dione
Compound characteristics
| Compound ID: | 8013-8546 |
| Compound Name: | 2-chloro-3-[4-(4-methylbenzene-1-sulfonyl)piperazin-1-yl]naphthalene-1,4-dione |
| Molecular Weight: | 430.91 |
| Molecular Formula: | C21 H19 Cl N2 O4 S |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)C1=C(C(c2ccccc2C1=O)=O)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1187 |
| logD: | 4.1187 |
| logSw: | -4.508 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 61.341 |
| InChI Key: | ZXNQOQRHMAICOM-UHFFFAOYSA-N |