Chemical ID: 6175678

CCOc1ccc(cc1)NC(=S)N(Cc2ccc(cc2)Cl)Cc3cccnc3
Chemical ID:
6175678
Name [?]:
1-[(4-chlorophenyl)methyl]-3-(4-ethoxyphenyl)-1-(3-pyridylmethyl)thiourea
SMILES [?]:
CCOc1ccc(cc1)NC(=S)N(Cc2ccc(cc2)Cl)Cc3cccnc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H22ClN3OS
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:12.2407
Area:636.249
Solvation:-3.66553
Coulombic:-33.6606
Bond Count [?]
All:30
Single:20
Double:10
Rotors:9
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:411.948
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.38
LogP (Chemaxon):5.18

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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