4-{[N-(cyclopropylmethyl)(ethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Chemical Structure Depiction of
4-{[N-(cyclopropylmethyl)(ethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
4-{[N-(cyclopropylmethyl)(ethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate
Compound characteristics
| Compound ID: | V030-5965 |
| Compound Name: | 4-{[N-(cyclopropylmethyl)(ethyl)carbamamido]methyl}phenyl 4-methoxybenzene-1-sulfonate |
| Molecular Weight: | 418.51 |
| Molecular Formula: | C21 H26 N2 O5 S |
| Smiles: | CCNC(N(CC1CC1)Cc1ccc(cc1)OS(c1ccc(cc1)OC)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5525 |
| logD: | 3.5525 |
| logSw: | -3.7026 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.047 |
| InChI Key: | CZTOJKUOODCNJH-UHFFFAOYSA-N |