butyl 2-[(4-{[N-di(propan-2-yl)carbamamido]methyl}phenoxy)sulfonyl]benzoate
Chemical Structure Depiction of
butyl 2-[(4-{[N-di(propan-2-yl)carbamamido]methyl}phenoxy)sulfonyl]benzoate
butyl 2-[(4-{[N-di(propan-2-yl)carbamamido]methyl}phenoxy)sulfonyl]benzoate
Compound characteristics
| Compound ID: | V029-9730 |
| Compound Name: | butyl 2-[(4-{[N-di(propan-2-yl)carbamamido]methyl}phenoxy)sulfonyl]benzoate |
| Molecular Weight: | 490.62 |
| Molecular Formula: | C25 H34 N2 O6 S |
| Smiles: | CCCCOC(c1ccccc1S(=O)(=O)Oc1ccc(CN(C(C)C)C(NC(C)C)=O)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1271 |
| logD: | 5.1271 |
| logSw: | -4.9556 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.391 |
| InChI Key: | RVFFQFQPQBIOQN-UHFFFAOYSA-N |