Chemical ID: 4367609

CCCc1c(nc(s1)NC(=O)c2cccc(c2)[N+](=O)[O-])c3ccc(cc3)OC
Chemical ID:
4367609
Name [?]:
N-[4-(4-methoxyphenyl)-5-propyl-thiazol-2-yl]-3-nitro-benzamide
SMILES [?]:
CCCc1c(nc(s1)NC(=O)c2cccc(c2)[N+](=O)[O-])c3ccc(cc3)OC
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H19N3O4S
All Atoms:28
Heavy Atoms:28
Chiral Atoms:0
ZAP Information [?]
Total:5.89336
Area:627.013
Solvation:-9.78198
Coulombic:-45.929
Bond Count [?]
All:30
Single:20
Double:10
Rotors:8
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:397.449
H-Bond Donors:1
H-Bond Acceptors:6
XLogP:4.19
LogP (Chemaxon):5.01

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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