N-[(2RS)-butan-2-yl]-7-chloro-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Chemical Structure Depiction of
N-[(2RS)-butan-2-yl]-7-chloro-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
N-[(2RS)-butan-2-yl]-7-chloro-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide
Compound characteristics
| Compound ID: | F083-0050 |
| Compound Name: | N-[(2RS)-butan-2-yl]-7-chloro-5-oxo-1-sulfanylidene-4,5-dihydro-1H-[1,3]thiazolo[3,4-a]quinazoline-3-carboxamide |
| Molecular Weight: | 367.87 |
| Molecular Formula: | C15 H14 Cl N3 O2 S2 |
| Smiles: | CC[C@H](C)NC(C1=C2NC(c3cc(ccc3N2C(=S)S1)[Cl])=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6627 |
| logD: | 2.6627 |
| logSw: | -3.5889 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 51.102 |
| InChI Key: | AOCRCVAVFQIYII-ZETCQYMHSA-N |