5-[2-({[(3-bromophenyl)methyl]amino}methyl)-1H-pyrrol-1-yl]-N,N-diethyl-1,3,4-thiadiazol-2-amine
Chemical Structure Depiction of
5-[2-({[(3-bromophenyl)methyl]amino}methyl)-1H-pyrrol-1-yl]-N,N-diethyl-1,3,4-thiadiazol-2-amine
5-[2-({[(3-bromophenyl)methyl]amino}methyl)-1H-pyrrol-1-yl]-N,N-diethyl-1,3,4-thiadiazol-2-amine
Compound characteristics
| Compound ID: | E958-1079 |
| Compound Name: | 5-[2-({[(3-bromophenyl)methyl]amino}methyl)-1H-pyrrol-1-yl]-N,N-diethyl-1,3,4-thiadiazol-2-amine |
| Molecular Weight: | 420.37 |
| Molecular Formula: | C18 H22 Br N5 S |
| Smiles: | CCN(CC)c1nnc(n2cccc2CNCc2cccc(c2)[Br])s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3266 |
| logD: | 4.2316 |
| logSw: | -4.3542 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.404 |
| InChI Key: | GEFALXTWNOWXNF-UHFFFAOYSA-N |