propan-2-yl 2-{[4-({ethyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenoxy]sulfonyl}benzoate
Chemical Structure Depiction of
propan-2-yl 2-{[4-({ethyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenoxy]sulfonyl}benzoate
propan-2-yl 2-{[4-({ethyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenoxy]sulfonyl}benzoate
Compound characteristics
| Compound ID: | V029-4536 |
| Compound Name: | propan-2-yl 2-{[4-({ethyl-N-[(furan-2-yl)methyl]carbamamido}methyl)phenoxy]sulfonyl}benzoate |
| Molecular Weight: | 500.57 |
| Molecular Formula: | C25 H28 N2 O7 S |
| Smiles: | CCNC(N(Cc1ccc(cc1)OS(c1ccccc1C(=O)OC(C)C)(=O)=O)Cc1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8887 |
| logD: | 3.8887 |
| logSw: | -3.9316 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.161 |
| InChI Key: | NVYZTMZDVKNKFQ-UHFFFAOYSA-N |