N-(2,5-dimethoxyphenyl)-2-{[(3-methylthiophen-2-yl)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxyphenyl)-2-{[(3-methylthiophen-2-yl)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
N-(2,5-dimethoxyphenyl)-2-{[(3-methylthiophen-2-yl)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Compound characteristics
| Compound ID: | K801-0612 |
| Compound Name: | N-(2,5-dimethoxyphenyl)-2-{[(3-methylthiophen-2-yl)methyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide |
| Molecular Weight: | 456.63 |
| Molecular Formula: | C24 H28 N2 O3 S2 |
| Smiles: | Cc1ccsc1CNc1c(C(Nc2cc(ccc2OC)OC)=O)c2CCCCCc2s1 |
| Stereo: | ACHIRAL |
| logP: | 6.1476 |
| logD: | 6.1463 |
| logSw: | -5.4392 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.105 |
| InChI Key: | YFMSTTGMOILRGT-UHFFFAOYSA-N |