butyl 2-{[5-(diethylamino)-2-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenoxy]sulfonyl}benzoate
Chemical Structure Depiction of
butyl 2-{[5-(diethylamino)-2-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenoxy]sulfonyl}benzoate
butyl 2-{[5-(diethylamino)-2-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenoxy]sulfonyl}benzoate
Compound characteristics
| Compound ID: | V029-4736 |
| Compound Name: | butyl 2-{[5-(diethylamino)-2-{[2-methyl-N-(propan-2-yl)propanamido]methyl}phenoxy]sulfonyl}benzoate |
| Molecular Weight: | 546.73 |
| Molecular Formula: | C29 H42 N2 O6 S |
| Salt: | not_available |
| Smiles: | CCCCOC(c1ccccc1S(=O)(=O)Oc1cc(ccc1CN(C(C)C)C(C(C)C)=O)N(CC)CC)=O |
| Stereo: | ACHIRAL |
| logP: | 6.216 |
| logD: | 6.2052 |
| logSw: | -5.4366 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 76.097 |
| InChI Key: | ZIHPEKLTOOZWDZ-UHFFFAOYSA-N |