N-benzyl-1-(5-methylthiophene-2-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Chemical Structure Depiction of
N-benzyl-1-(5-methylthiophene-2-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
N-benzyl-1-(5-methylthiophene-2-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide
Compound characteristics
| Compound ID: | S733-0733 |
| Compound Name: | N-benzyl-1-(5-methylthiophene-2-carbonyl)-4-oxo-1,5-diazacycloundecane-8-carboxamide |
| Molecular Weight: | 427.56 |
| Molecular Formula: | C23 H29 N3 O3 S |
| Smiles: | Cc1ccc(C(N2CCCC(CCNC(CC2)=O)C(NCc2ccccc2)=O)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7553 |
| logD: | 1.7553 |
| logSw: | -2.1793 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.673 |
| InChI Key: | OAZRAFVJGMTLSM-IBGZPJMESA-N |