methyl 4-[(6-bromo-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(6-bromo-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carbonyl)amino]benzoate
methyl 4-[(6-bromo-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | Y044-5203 |
| Compound Name: | methyl 4-[(6-bromo-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carbonyl)amino]benzoate |
| Molecular Weight: | 428.28 |
| Molecular Formula: | C20 H18 Br N3 O3 |
| Smiles: | COC(c1ccc(cc1)NC(N1CCc2c(C1)c1cccc(c1[nH]2)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8432 |
| logD: | 3.8432 |
| logSw: | -4.2325 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 58.164 |
| InChI Key: | PXAMNQISNGRUSW-UHFFFAOYSA-N |