5-methyl-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-carboxamide
Chemical Structure Depiction of
5-methyl-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-carboxamide
5-methyl-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-carboxamide
Compound characteristics
Compound ID: | S796-0342 |
Compound Name: | 5-methyl-N-[2-oxo-2-(4-oxo-2-phenyl-1,5-diazacycloundecan-1-yl)ethyl]thiophene-2-carboxamide |
Molecular Weight: | 427.56 |
Molecular Formula: | C23 H29 N3 O3 S |
Smiles: | Cc1ccc(C(NCC(N2CCCCCCNC(CC2c2ccccc2)=O)=O)=O)s1 |
Stereo: | RACEMIC MIXTURE |
logP: | 3.0185 |
logD: | 3.0185 |
logSw: | -3.1588 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 66.84 |
InChI Key: | IFHIMXDCZICXIN-IBGZPJMESA-N |