N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-ethylanilino)-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-ethylanilino)-4-methyl-1,3-thiazole-5-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-ethylanilino)-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
Compound ID: | M830-2533 |
Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-ethylanilino)-4-methyl-1,3-thiazole-5-carboxamide |
Molecular Weight: | 395.48 |
Molecular Formula: | C21 H21 N3 O3 S |
Smiles: | CCc1ccccc1Nc1nc(C)c(C(Nc2ccc3c(c2)OCCO3)=O)s1 |
Stereo: | ACHIRAL |
logP: | 4.2615 |
logD: | 4.2585 |
logSw: | -4.2007 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 57.991 |
InChI Key: | SPJMIPVKOCKFOH-UHFFFAOYSA-N |