3-(3-chloro-4-methoxyphenyl)-5-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
3-(3-chloro-4-methoxyphenyl)-5-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
3-(3-chloro-4-methoxyphenyl)-5-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0202 |
| Compound Name: | 3-(3-chloro-4-methoxyphenyl)-5-methyl-N-({1-[(3-methylphenyl)methyl]piperidin-4-yl}methyl)-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 584.12 |
| Molecular Formula: | C33 H34 Cl N5 O3 |
| Smiles: | Cc1cccc(CN2CCC(CC2)CNC(C2c3c4ccccc4n(C)c3C(N(c3ccc(c(c3)[Cl])OC)N=2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 5.4329 |
| logD: | 2.9405 |
| logSw: | -6.1604 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.747 |
| InChI Key: | LTTVXUIYNFRHSM-UHFFFAOYSA-N |