N-[(5-methylfuran-2-yl)methyl]-4-{[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
Chemical Structure Depiction of
N-[(5-methylfuran-2-yl)methyl]-4-{[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
N-[(5-methylfuran-2-yl)methyl]-4-{[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)amino]methyl}cyclohexane-1-carboxamide
Compound characteristics
| Compound ID: | G017-0358 |
| Compound Name: | N-[(5-methylfuran-2-yl)methyl]-4-{[(2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepine-7-sulfonyl)amino]methyl}cyclohexane-1-carboxamide |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C24 H31 N3 O5 S |
| Smiles: | Cc1ccc(CNC(C2CCC(CC2)CNS(c2ccc3c(CCCC(N3)=O)c2)(=O)=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.1053 |
| logD: | 3.1052 |
| logSw: | -3.4555 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 99.017 |
| InChI Key: | FOGSPUAURZHVCN-UHFFFAOYSA-N |