3-bromo-N'-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]benzohydrazide
Chemical Structure Depiction of
3-bromo-N'-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]benzohydrazide
3-bromo-N'-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]benzohydrazide
Compound characteristics
Compound ID: | 1185-0070 |
Compound Name: | 3-bromo-N'-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(prop-2-en-1-yl)-1,3-thiazol-2(3H)-ylidene]benzohydrazide |
Molecular Weight: | 553.27 |
Molecular Formula: | C21 H18 Br N3 O3 S |
Salt: | HBr |
Smiles: | C=CCN1C(=CSC\1=N/NC(c1cccc(c1)[Br])=O)c1ccc2c(c1)OCCO2 |
Stereo: | ACHIRAL |
logP: | 4.4571 |
logD: | 3.5799 |
logSw: | -4.4993 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 54.523 |
InChI Key: | IYKOHLRKPADHFA-UHFFFAOYSA-N |