4-{[(4-acetamidobenzene-1-sulfonyl)amino]methyl}-N-[(2H-1,3-benzodioxol-5-yl)methyl]cyclohexane-1-carboxamide
Chemical Structure Depiction of
4-{[(4-acetamidobenzene-1-sulfonyl)amino]methyl}-N-[(2H-1,3-benzodioxol-5-yl)methyl]cyclohexane-1-carboxamide
4-{[(4-acetamidobenzene-1-sulfonyl)amino]methyl}-N-[(2H-1,3-benzodioxol-5-yl)methyl]cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | K938-0734F |
| Compound Name: | 4-{[(4-acetamidobenzene-1-sulfonyl)amino]methyl}-N-[(2H-1,3-benzodioxol-5-yl)methyl]cyclohexane-1-carboxamide |
| Molecular Weight: | 487.57 |
| Molecular Formula: | C24 H29 N3 O6 S |
| Smiles: | CC(Nc1ccc(cc1)S(NCC1CCC(CC1)C(NCc1ccc2c(c1)OCO2)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8706 |
| logD: | 2.8703 |
| logSw: | -3.3764 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 106.98 |
| InChI Key: | IINFBGVRRDHVDW-UHFFFAOYSA-N |