tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazine-1-carboxylate
tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | M036-0286 |
| Compound Name: | tert-butyl 4-[3-(1H-pyrrol-1-yl)thieno[2,3-b]pyridine-2-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C21 H24 N4 O3 S |
| Smiles: | CC(C)(C)OC(N1CCN(CC1)C(c1c(c2cccnc2s1)n1cccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0472 |
| logD: | 4.0381 |
| logSw: | -4.0698 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.313 |
| InChI Key: | FFSAGZYHMLXMLV-UHFFFAOYSA-N |