(3-chloro-6-nitro-1-benzothiophen-2-yl)(piperazin-1-yl)methanone
Chemical Structure Depiction of
(3-chloro-6-nitro-1-benzothiophen-2-yl)(piperazin-1-yl)methanone
(3-chloro-6-nitro-1-benzothiophen-2-yl)(piperazin-1-yl)methanone
Compound characteristics
| Compound ID: | Y507-1844 |
| Compound Name: | (3-chloro-6-nitro-1-benzothiophen-2-yl)(piperazin-1-yl)methanone |
| Molecular Weight: | 325.77 |
| Molecular Formula: | C13 H12 Cl N3 O3 S |
| Smiles: | C1CN(CCN1)C(c1c(c2ccc(cc2s1)[N+]([O-])=O)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 2.3924 |
| logD: | 1.8469 |
| logSw: | -3.7698 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.976 |
| InChI Key: | YSSCJSZEFBLRIZ-UHFFFAOYSA-N |