(5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}thiophen-3-yl)(pyrrolidin-1-yl)methanone
Chemical Structure Depiction of
(5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}thiophen-3-yl)(pyrrolidin-1-yl)methanone
(5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}thiophen-3-yl)(pyrrolidin-1-yl)methanone
Compound characteristics
| Compound ID: | F540-0158 |
| Compound Name: | (5-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazine-1-sulfonyl}thiophen-3-yl)(pyrrolidin-1-yl)methanone |
| Molecular Weight: | 463.57 |
| Molecular Formula: | C21 H25 N3 O5 S2 |
| Smiles: | C1CCN(C1)C(c1cc(sc1)S(N1CCN(CC1)Cc1ccc2c(c1)OCO2)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.129 |
| logD: | 1.9965 |
| logSw: | -2.7544 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.638 |
| InChI Key: | TXUQEYHPWDPPIK-UHFFFAOYSA-N |