5-[2-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1H-pyrrol-1-yl]-N,N-diethyl-1,3,4-thiadiazol-2-amine
Chemical Structure Depiction of
5-[2-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1H-pyrrol-1-yl]-N,N-diethyl-1,3,4-thiadiazol-2-amine
5-[2-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1H-pyrrol-1-yl]-N,N-diethyl-1,3,4-thiadiazol-2-amine
Compound characteristics
| Compound ID: | E958-1044 |
| Compound Name: | 5-[2-({[2-(3,4-dimethoxyphenyl)ethyl]amino}methyl)-1H-pyrrol-1-yl]-N,N-diethyl-1,3,4-thiadiazol-2-amine |
| Molecular Weight: | 415.56 |
| Molecular Formula: | C21 H29 N5 O2 S |
| Smiles: | CCN(CC)c1nnc(n2cccc2CNCCc2ccc(c(c2)OC)OC)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.9188 |
| logD: | 2.8158 |
| logSw: | -3.2855 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.506 |
| InChI Key: | WONPAQNHAGPHNQ-UHFFFAOYSA-N |