N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-4-methylaniline
Chemical Structure Depiction of
N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-4-methylaniline
N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-4-methylaniline
Compound characteristics
| Compound ID: | E958-1491 |
| Compound Name: | N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)-4-methylaniline |
| Molecular Weight: | 367.51 |
| Molecular Formula: | C20 H25 N5 S |
| Smiles: | Cc1ccc(cc1)NCc1cccn1c1nnc(N2CCCCCC2)s1 |
| Stereo: | ACHIRAL |
| logP: | 5.2634 |
| logD: | 5.2634 |
| logSw: | -5.0468 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.92 |
| InChI Key: | FDJKURIMXJJPKS-UHFFFAOYSA-N |