4-[(butyl-N-cyclopropylcarbamamido)methyl]phenyl ethanesulfonate
Chemical Structure Depiction of
4-[(butyl-N-cyclopropylcarbamamido)methyl]phenyl ethanesulfonate
4-[(butyl-N-cyclopropylcarbamamido)methyl]phenyl ethanesulfonate
Compound characteristics
| Compound ID: | V029-2389 |
| Compound Name: | 4-[(butyl-N-cyclopropylcarbamamido)methyl]phenyl ethanesulfonate |
| Molecular Weight: | 354.47 |
| Molecular Formula: | C17 H26 N2 O4 S |
| Smiles: | CCCCNC(N(Cc1ccc(cc1)OS(CC)(=O)=O)C1CC1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3519 |
| logD: | 3.3519 |
| logSw: | -3.6089 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.118 |
| InChI Key: | UFFAVBXEARPKAR-UHFFFAOYSA-N |