N-(5-{[(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
Chemical Structure Depiction of
N-(5-{[(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
N-(5-{[(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide
Compound characteristics
| Compound ID: | G072-2358 |
| Compound Name: | N-(5-{[(4-oxo-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-2-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)furan-2-carboxamide |
| Molecular Weight: | 445.54 |
| Molecular Formula: | C18 H15 N5 O3 S3 |
| Smiles: | C1CCC2=C(C1)N1C(=NC(CSc3nnc(NC(c4ccco4)=O)s3)=CC1=O)S2 |
| Stereo: | ACHIRAL |
| logP: | 3.1261 |
| logD: | 3.1095 |
| logSw: | -3.4584 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.679 |
| InChI Key: | ICTIMRVPSGTQEF-UHFFFAOYSA-N |