2-({methyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-({methyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-({methyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | G769-0784 |
| Compound Name: | 2-({methyl[(3,4,5-trimethoxyphenyl)methyl]amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 429.54 |
| Molecular Formula: | C22 H27 N3 O4 S |
| Smiles: | CN(CC1=CC(N2C3CCCCC=3SC2=N1)=O)Cc1cc(c(c(c1)OC)OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.2984 |
| logD: | -0.4551 |
| logSw: | -2.5848 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 53.197 |
| InChI Key: | FMODQAIUBFVSKI-UHFFFAOYSA-N |