Chemical ID: 6149485

CC1=C(C(n2c(nc(n2)c3cccnc3)N1)c4cccs4)C(=O)Nc5cccnc5
Chemical ID:
6149485
Name [?]:
4-methyl-N,8-bis(3-pyridyl)-2-(2-thienyl)-1,5,7,9-tetrazabicyclo[4.3.0]nona-3,6,8-triene-3-carboxamide
SMILES [?]:
CC1=C(C(n2c(nc(n2)c3cccnc3)N1)c4cccs4)C(=O)Nc5cccnc5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H17N7OS
All Atoms:30
Heavy Atoms:30
Chiral Atoms:1
ZAP Information [?]
Total:11.0153
Area:596.199
Solvation:-3.88968
Coulombic:-54.5584
Bond Count [?]
All:34
Single:22
Double:12
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:415.472
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:1.68
LogP (Chemaxon):1.37

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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