1-(3-methoxyphenyl)-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Chemical Structure Depiction of
1-(3-methoxyphenyl)-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
1-(3-methoxyphenyl)-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine
Compound characteristics
| Compound ID: | E958-0820 |
| Compound Name: | 1-(3-methoxyphenyl)-N-({1-[5-(4-phenylpiperazin-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)methanamine |
| Molecular Weight: | 460.6 |
| Molecular Formula: | C25 H28 N6 O S |
| Smiles: | COc1cccc(CNCc2cccn2c2nnc(N3CCN(CC3)c3ccccc3)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.5086 |
| logD: | 3.6139 |
| logSw: | -4.3478 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.924 |
| InChI Key: | BZKSQQXINBVDCB-UHFFFAOYSA-N |