4-[(6-chloro-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl)amino]butanoic acid
Chemical Structure Depiction of
4-[(6-chloro-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl)amino]butanoic acid
4-[(6-chloro-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl)amino]butanoic acid
Compound characteristics
| Compound ID: | Y043-2501 |
| Compound Name: | 4-[(6-chloro-1,3,4,9-tetrahydro-2H-pyrido[3,4-b]indole-2-carbonyl)amino]butanoic acid |
| Molecular Weight: | 335.79 |
| Molecular Formula: | C16 H18 Cl N3 O3 |
| Smiles: | C(CC(O)=O)CNC(N1CCc2c3cc(ccc3[nH]c2C1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 1.6104 |
| logD: | -1.2105 |
| logSw: | -2.5921 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 66.038 |
| InChI Key: | GHMZBEKHUPNBSA-UHFFFAOYSA-N |