methyl 2-{[(cyclohexylmethyl)({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]methyl}benzoate
Chemical Structure Depiction of
methyl 2-{[(cyclohexylmethyl)({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]methyl}benzoate
methyl 2-{[(cyclohexylmethyl)({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]methyl}benzoate
Compound characteristics
| Compound ID: | V008-7964 |
| Compound Name: | methyl 2-{[(cyclohexylmethyl)({1-[(3-methylphenyl)methyl]-1H-pyrrol-2-yl}methyl)amino]methyl}benzoate |
| Molecular Weight: | 444.62 |
| Molecular Formula: | C29 H36 N2 O2 |
| Salt: | not_available |
| Smiles: | Cc1cccc(Cn2cccc2CN(CC2CCCCC2)Cc2ccccc2C(=O)OC)c1 |
| Stereo: | ACHIRAL |
| logP: | 7.023 |
| logD: | 6.633 |
| logSw: | -5.7504 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.1149 |
| InChI Key: | DDTMHNSXXCSZJB-UHFFFAOYSA-N |