heptyl 4-{[4-(2-acetamidoethyl)benzene-1-sulfonyl]amino}benzoate
Chemical Structure Depiction of
heptyl 4-{[4-(2-acetamidoethyl)benzene-1-sulfonyl]amino}benzoate
heptyl 4-{[4-(2-acetamidoethyl)benzene-1-sulfonyl]amino}benzoate
Compound characteristics
| Compound ID: | 8015-1857 |
| Compound Name: | heptyl 4-{[4-(2-acetamidoethyl)benzene-1-sulfonyl]amino}benzoate |
| Molecular Weight: | 460.59 |
| Molecular Formula: | C24 H32 N2 O5 S |
| Smiles: | CCCCCCCOC(c1ccc(cc1)NS(c1ccc(CCNC(C)=O)cc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8001 |
| logD: | 4.3368 |
| logSw: | -4.5056 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 86.361 |
| InChI Key: | KVPJVPXLUOAIDJ-UHFFFAOYSA-N |