N-{[2-(dimethylamino)-5-(4-nitrobenzamido)phenyl]methyl}-N-[(oxolan-2-yl)methyl]thiophene-2-carboxamide
Chemical Structure Depiction of
N-{[2-(dimethylamino)-5-(4-nitrobenzamido)phenyl]methyl}-N-[(oxolan-2-yl)methyl]thiophene-2-carboxamide
N-{[2-(dimethylamino)-5-(4-nitrobenzamido)phenyl]methyl}-N-[(oxolan-2-yl)methyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | V005-9928 |
| Compound Name: | N-{[2-(dimethylamino)-5-(4-nitrobenzamido)phenyl]methyl}-N-[(oxolan-2-yl)methyl]thiophene-2-carboxamide |
| Molecular Weight: | 508.6 |
| Molecular Formula: | C26 H28 N4 O5 S |
| Salt: | not_available |
| Smiles: | CN(C)c1ccc(cc1CN(CC1CCCO1)C(c1cccs1)=O)NC(c1ccc(cc1)[N+]([O-])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2157 |
| logD: | 4.2027 |
| logSw: | -4.3353 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.827 |
| InChI Key: | FKYWJLKGCNTDFH-JOCHJYFZSA-N |