2-({[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-({[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-({[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | G808-0040 |
| Compound Name: | 2-({[2-(3,5-dimethyl-1,2-oxazol-4-yl)ethyl]sulfanyl}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 375.51 |
| Molecular Formula: | C18 H21 N3 O2 S2 |
| Smiles: | Cc1c(CCSCC2=CC(N3C4CCCCC=4SC3=N2)=O)c(C)on1 |
| Stereo: | ACHIRAL |
| logP: | 2.9215 |
| logD: | 2.9215 |
| logSw: | -3.0818 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.141 |
| InChI Key: | SZCUERNQOOVKIK-UHFFFAOYSA-N |