N-{2-[benzyl(methyl)amino]ethyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Chemical Structure Depiction of
N-{2-[benzyl(methyl)amino]ethyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
N-{2-[benzyl(methyl)amino]ethyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide
Compound characteristics
| Compound ID: | C507-0229 |
| Compound Name: | N-{2-[benzyl(methyl)amino]ethyl}-3-(3-chloro-4-methoxyphenyl)-5-methyl-4-oxo-4,5-dihydro-3H-pyridazino[4,5-b]indole-1-carboxamide |
| Molecular Weight: | 530.03 |
| Molecular Formula: | C29 H28 Cl N5 O3 |
| Smiles: | CN(CCNC(C1c2c3ccccc3n(C)c2C(N(c2ccc(c(c2)[Cl])OC)N=1)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 3.8681 |
| logD: | 3.5169 |
| logSw: | -4.6392 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.95 |
| InChI Key: | VLNDFDTWQAUDDR-UHFFFAOYSA-N |