Chemical ID: 6175044

CC(C)c1ccc(cc1)CN(Cc2ccc(cc2)OC)C(=S)Nc3ccc(cc3)Br
Chemical ID:
6175044
Name [?]:
3-(4-bromophenyl)-1-[(4-isopropylphenyl)methyl]-1-[(4-methoxyphenyl)methyl]thiourea
SMILES [?]:
CC(C)c1ccc(cc1)CN(Cc2ccc(cc2)OC)C(=S)Nc3ccc(cc3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H27BrN2OS
All Atoms:30
Heavy Atoms:30
Chiral Atoms:0
ZAP Information [?]
Total:13.7766
Area:674.457
Solvation:-3.08478
Coulombic:-30.7246
Bond Count [?]
All:32
Single:22
Double:10
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:483.465
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:7.79
LogP (Chemaxon):7.61

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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