N-(4-ethoxy-2-nitrophenyl)-2-(naphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Chemical Structure Depiction of
N-(4-ethoxy-2-nitrophenyl)-2-(naphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
N-(4-ethoxy-2-nitrophenyl)-2-(naphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide
Compound characteristics
| Compound ID: | 8014-8291 |
| Compound Name: | N-(4-ethoxy-2-nitrophenyl)-2-(naphthalene-2-sulfonyl)-1,2,3,4-tetrahydroisoquinoline-3-carboxamide |
| Molecular Weight: | 531.59 |
| Molecular Formula: | C28 H25 N3 O6 S |
| Smiles: | CCOc1ccc(c(c1)[N+]([O-])=O)NC(C1Cc2ccccc2CN1S(c1ccc2ccccc2c1)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.2786 |
| logD: | 4.7076 |
| logSw: | -6.3731 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.408 |
| InChI Key: | GTFJPILXYPXNTN-MHZLTWQESA-N |