4-(8-chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carbonyl)-2-methylisoquinolin-1(2H)-one
Chemical Structure Depiction of
4-(8-chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carbonyl)-2-methylisoquinolin-1(2H)-one
4-(8-chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carbonyl)-2-methylisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | Y041-3763 |
| Compound Name: | 4-(8-chloro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carbonyl)-2-methylisoquinolin-1(2H)-one |
| Molecular Weight: | 391.86 |
| Molecular Formula: | C22 H18 Cl N3 O2 |
| Smiles: | CN1C=C(C(N2CCc3c(C2)c2cc(ccc2[nH]3)[Cl])=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.355 |
| logD: | 2.355 |
| logSw: | -3.5973 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.347 |
| InChI Key: | XMXVRSLZIRXQKA-UHFFFAOYSA-N |