{1-[5-(morpholin-4-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}[4-(4-nitrophenyl)piperazin-1-yl]methanone
Chemical Structure Depiction of
{1-[5-(morpholin-4-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}[4-(4-nitrophenyl)piperazin-1-yl]methanone
{1-[5-(morpholin-4-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}[4-(4-nitrophenyl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | G015-0052 |
| Compound Name: | {1-[5-(morpholin-4-yl)-1,3,4-thiadiazol-2-yl]-1H-pyrrol-2-yl}[4-(4-nitrophenyl)piperazin-1-yl]methanone |
| Molecular Weight: | 469.52 |
| Molecular Formula: | C21 H23 N7 O4 S |
| Smiles: | C1CN(CCN1C(c1cccn1c1nnc(N2CCOCC2)s1)=O)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 2.9709 |
| logD: | 2.9709 |
| logSw: | -3.2563 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 90.072 |
| InChI Key: | ZOOPPNWARNQWEX-UHFFFAOYSA-N |