N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)cyclohexanamine
Chemical Structure Depiction of
N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)cyclohexanamine
N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)cyclohexanamine
Compound characteristics
| Compound ID: | E958-1493 |
| Compound Name: | N-({1-[5-(azepan-1-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}methyl)cyclohexanamine |
| Molecular Weight: | 359.54 |
| Molecular Formula: | C19 H29 N5 S |
| Smiles: | C1CCC(CC1)NCc1cccn1c1nnc(N2CCCCCC2)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5277 |
| logD: | 3.9183 |
| logSw: | -4.1767 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.967 |
| InChI Key: | IPTZDNYWODUGDC-UHFFFAOYSA-N |