N-{(2S)-1-[(1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl}-4-(pyrimidin-2-yl)piperazine-1-carboxamide
Chemical Structure Depiction of
N-{(2S)-1-[(1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl}-4-(pyrimidin-2-yl)piperazine-1-carboxamide
N-{(2S)-1-[(1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl}-4-(pyrimidin-2-yl)piperazine-1-carboxamide
Compound characteristics
| Compound ID: | Y043-6408 |
| Compound Name: | N-{(2S)-1-[(1,3-benzothiazol-2-yl)amino]-1-oxopropan-2-yl}-4-(pyrimidin-2-yl)piperazine-1-carboxamide |
| Molecular Weight: | 411.48 |
| Molecular Formula: | C19 H21 N7 O2 S |
| Smiles: | C[C@@H](C(Nc1nc2ccccc2s1)=O)NC(N1CCN(CC1)c1ncccn1)=O |
| Stereo: | ABSOLUTE |
| logP: | 3.0779 |
| logD: | 3.0777 |
| logSw: | -3.3926 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.94 |
| InChI Key: | GDPITBWRRZXTBW-ZDUSSCGKSA-N |