Chemical ID: 5893273

COc1cccc(c1)CSc2nnc(n2c3ccc(cc3Cl)Cl)CNC(=O)c4ccco4
Chemical ID:
5893273
Name [?]:
N-[[4-(2,4-dichlorophenyl)-5-[(3-methoxyphenyl)methylsulfanyl]-1,2,4-triazol-3-yl]methyl]furan-2-carboxamide
SMILES [?]:
COc1cccc(c1)CSc2nnc(n2c3ccc(cc3Cl)Cl)CNC(=O)c4ccco4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C22H18Cl2N4O3S
All Atoms:32
Heavy Atoms:32
Chiral Atoms:0
ZAP Information [?]
Total:13.6262
Area:724.726
Solvation:-4.4919
Coulombic:-51.546
Bond Count [?]
All:35
Single:24
Double:11
Rotors:9
Chiral:0
Rigid Segments:8
Chemical Properties
Molecular Weight:489.375
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:6.1
LogP (Chemaxon):3.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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