N-(5-benzyl-4-oxo-5,6-dihydro-4H-pyrrolo[3,4-d][1,3]thiazol-2-yl)-N'-(3,4-dimethoxyphenyl)urea
Chemical Structure Depiction of
N-(5-benzyl-4-oxo-5,6-dihydro-4H-pyrrolo[3,4-d][1,3]thiazol-2-yl)-N'-(3,4-dimethoxyphenyl)urea
N-(5-benzyl-4-oxo-5,6-dihydro-4H-pyrrolo[3,4-d][1,3]thiazol-2-yl)-N'-(3,4-dimethoxyphenyl)urea
Compound characteristics
Compound ID: | T416-0145 |
Compound Name: | N-(5-benzyl-4-oxo-5,6-dihydro-4H-pyrrolo[3,4-d][1,3]thiazol-2-yl)-N'-(3,4-dimethoxyphenyl)urea |
Molecular Weight: | 424.48 |
Molecular Formula: | C21 H20 N4 O4 S |
Smiles: | [H]N(C(Nc1ccc(c(c1)OC)OC)=O)c1nc2C(N(Cc3ccccc3)Cc2s1)=O |
Stereo: | ACHIRAL |
logP: | 3.4673 |
logD: | 3.465 |
logSw: | -3.775 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 75.356 |
InChI Key: | GXWJQQGNAZUNSW-UHFFFAOYSA-N |