Chemical ID: 4404073

COc1ccc(c(c1)OC)NC(=S)NCc2ccc3c(c2)OCO3
Chemical ID:
4404073
Name [?]:
3-(benzo[1,3]dioxol-5-ylmethyl)-1-(2,4-dimethoxyphenyl)-thiourea
SMILES [?]:
COc1ccc(c(c1)OC)NC(=S)NCc2ccc3c(c2)OCO3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H18N2O4S
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:8.59532
Area:554.376
Solvation:-5.26409
Coulombic:-55.4391
Bond Count [?]
All:26
Single:19
Double:7
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:346.402
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:2.99
LogP (Chemaxon):3.04

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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