1-amino-2-(1,3-benzothiazol-2-yl)-3-(4-chlorophenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile
Chemical Structure Depiction of
1-amino-2-(1,3-benzothiazol-2-yl)-3-(4-chlorophenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile
1-amino-2-(1,3-benzothiazol-2-yl)-3-(4-chlorophenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile
Compound characteristics
| Compound ID: | 8006-4042 |
| Compound Name: | 1-amino-2-(1,3-benzothiazol-2-yl)-3-(4-chlorophenyl)-3H-pyrido[2,1-b][1,3]benzothiazole-4-carbonitrile |
| Molecular Weight: | 471 |
| Molecular Formula: | C25 H15 Cl N4 S2 |
| Smiles: | C(C1C(C(=C(N)N2C=1Sc1ccccc12)c1nc2ccccc2s1)c1ccc(cc1)[Cl])#N |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.0756 |
| logD: | 6.0756 |
| logSw: | -6.7704 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.011 |
| InChI Key: | WNUYVGYBPAQSLC-OAQYLSRUSA-N |