butyl 2-{[5-(diethylamino)-2-{[N-di(propan-2-yl)carbamamido]methyl}phenoxy]sulfonyl}benzoate
Chemical Structure Depiction of
butyl 2-{[5-(diethylamino)-2-{[N-di(propan-2-yl)carbamamido]methyl}phenoxy]sulfonyl}benzoate
butyl 2-{[5-(diethylamino)-2-{[N-di(propan-2-yl)carbamamido]methyl}phenoxy]sulfonyl}benzoate
Compound characteristics
| Compound ID: | V030-6257 |
| Compound Name: | butyl 2-{[5-(diethylamino)-2-{[N-di(propan-2-yl)carbamamido]methyl}phenoxy]sulfonyl}benzoate |
| Molecular Weight: | 561.74 |
| Molecular Formula: | C29 H43 N3 O6 S |
| Salt: | not_available |
| Smiles: | CCCCOC(c1ccccc1S(=O)(=O)Oc1cc(ccc1CN(C(C)C)C(NC(C)C)=O)N(CC)CC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.2064 |
| logD: | 6.1956 |
| logSw: | -5.4152 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.214 |
| InChI Key: | IFHXCQITYZRZES-UHFFFAOYSA-N |