2-({benzyl[(4-methoxyphenyl)methyl]amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Chemical Structure Depiction of
2-({benzyl[(4-methoxyphenyl)methyl]amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
2-({benzyl[(4-methoxyphenyl)methyl]amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one
Compound characteristics
| Compound ID: | G769-0472 |
| Compound Name: | 2-({benzyl[(4-methoxyphenyl)methyl]amino}methyl)-6,7,8,9-tetrahydro-4H-pyrimido[2,1-b][1,3]benzothiazol-4-one |
| Molecular Weight: | 445.58 |
| Molecular Formula: | C26 H27 N3 O2 S |
| Smiles: | COc1ccc(CN(CC2=CC(N3C4CCCCC=4SC3=N2)=O)Cc2ccccc2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 4.1027 |
| logD: | 4.0715 |
| logSw: | -4.2568 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 37.359 |
| InChI Key: | GRCMJHAHYALSKR-UHFFFAOYSA-N |