methyl 4-[(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl)amino]benzoate
methyl 4-[(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | Y043-6333 |
| Compound Name: | methyl 4-[(1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl)amino]benzoate |
| Molecular Weight: | 349.39 |
| Molecular Formula: | C20 H19 N3 O3 |
| Smiles: | COC(c1ccc(cc1)NC(N1CCc2c3ccccc3[nH]c2C1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8705 |
| logD: | 2.8705 |
| logSw: | -3.3937 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.393 |
| InChI Key: | KDSDXIUXRSETOQ-UHFFFAOYSA-N |