Chemical ID: 6320231

Cc1ccc(cc1)CNC(=S)Nc2ccc3c(c2)OCO3
Chemical ID:
6320231
Name [?]:
3-benzo[1,3]dioxol-5-yl-1-(p-tolylmethyl)thiourea
SMILES [?]:
Cc1ccc(cc1)CNC(=S)Nc2ccc3c(c2)OCO3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H16N2O2S
All Atoms:21
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:9.83491
Area:502.687
Solvation:-2.73226
Coulombic:-42.0059
Bond Count [?]
All:23
Single:16
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:300.377
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.59
LogP (Chemaxon):4.01

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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