Chemical ID: 6128135

COc1ccc(cc1)CN(Cc2cccc(c2)Cl)C(=S)Nc3ccc(cc3)Cl
Chemical ID:
6128135
Name [?]:
3-(4-chlorophenyl)-1-[(3-chlorophenyl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea
SMILES [?]:
COc1ccc(cc1)CN(Cc2cccc(c2)Cl)C(=S)Nc3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H20Cl2N2OS
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:12.9435
Area:642.305
Solvation:-3.11414
Coulombic:-30.7522
Bond Count [?]
All:30
Single:20
Double:10
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:431.378
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:6.83
LogP (Chemaxon):6.66

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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