Chemical ID: 6030904

CCC(C)NC(=O)c1csc(n1)CN(CCc2ccc(c(c2)OC)OC)Cc3ccc(cc3)F
Chemical ID:
6030904
Name [?]:
2-[[2-(3,4-dimethoxyphenyl)ethyl-[(4-fluorophenyl)methyl]amino]methyl]-N-sec-butyl-thiazole-4-carboxamide
SMILES [?]:
CCC(C)NC(=O)c1csc(n1)CN(CCc2ccc(c(c2)OC)OC)Cc3ccc(cc3)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H32FN3O3S
All Atoms:34
Heavy Atoms:34
Chiral Atoms:2
ZAP Information [?]
Total:12.078
Area:760.646
Solvation:-6.93818
Coulombic:-53.0468
Bond Count [?]
All:36
Single:27
Double:9
Rotors:13
Chiral:0
Rigid Segments:10
Chemical Properties
Molecular Weight:485.615
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:4.25
LogP (Chemaxon):4.51

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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