N-benzyl-1-(3-methoxybenzene-1-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(3-methoxybenzene-1-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-(3-methoxybenzene-1-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0958 |
| Compound Name: | N-benzyl-1-(3-methoxybenzene-1-sulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 473.59 |
| Molecular Formula: | C24 H31 N3 O5 S |
| Smiles: | COc1cccc(c1)S(N1CCCC(CCNC(CC1)=O)C(NCc1ccccc1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.3238 |
| logD: | 1.3238 |
| logSw: | -2.4498 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.261 |
| InChI Key: | MSVHEGDQNOKXPG-FQEVSTJZSA-N |