N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-(methanesulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-(methanesulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-(methanesulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-3196 |
| Compound Name: | N-[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]-1-(methanesulfonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 414.52 |
| Molecular Formula: | C18 H30 N4 O5 S |
| Smiles: | Cc1c(CCNC(C2CCCN(CCC(NCC2)=O)S(C)(=O)=O)=O)c(C)on1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | -0.9354 |
| logD: | -0.9354 |
| logSw: | -1.3372 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.361 |
| InChI Key: | AFOWLKUPFAZFCG-HNNXBMFYSA-N |