4-({[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]amino}methyl)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one--oxalic acid (1/1)
Chemical Structure Depiction of
4-({[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]amino}methyl)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one--oxalic acid (1/1)
4-({[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]amino}methyl)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 8013-0622 |
| Compound Name: | 4-({[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]amino}methyl)-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one--oxalic acid (1/1) |
| Molecular Weight: | 494.55 |
| Molecular Formula: | C24 H28 N4 O2 |
| Salt: | HOOCCOOH |
| Smiles: | CC1=C(CNCCc2c3cc(ccc3[nH]c2C)OC)C(N(c2ccccc2)N1C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.622 |
| logD: | -0.6691 |
| logSw: | -3.066 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.498 |
| InChI Key: | QKVFCPVVVPXKQD-UHFFFAOYSA-N |