N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{3-[3-(thiomorpholin-4-yl)pyrazin-2-yl]phenyl}urea
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{3-[3-(thiomorpholin-4-yl)pyrazin-2-yl]phenyl}urea
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{3-[3-(thiomorpholin-4-yl)pyrazin-2-yl]phenyl}urea
Compound characteristics
Compound ID: | P130-0650 |
Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{3-[3-(thiomorpholin-4-yl)pyrazin-2-yl]phenyl}urea |
Molecular Weight: | 449.53 |
Molecular Formula: | C23 H23 N5 O3 S |
Smiles: | C1CSCCN1c1c(c2cccc(c2)NC(Nc2ccc3c(c2)OCCO3)=O)nccn1 |
Stereo: | ACHIRAL |
logP: | 3.5396 |
logD: | 3.5395 |
logSw: | -3.6628 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 70.345 |
InChI Key: | XSSNHXYFMPSCRB-UHFFFAOYSA-N |