Chemical ID: 6851298

CCOc1cc(ccc1OCc2ccccc2C)C3C(C(=C)Nc4n3ncn4)C(=O)N
Chemical ID:
6851298
Name [?]:
5-[3-ethoxy-4-(o-tolylmethoxy)phenyl]-3-methylene-2,6,7,9-tetrazabicyclo[4.3.0]nona-7,9-diene-4-carboxamide
SMILES [?]:
CCOc1cc(ccc1OCc2ccccc2C)C3C(C(=C)Nc4n3ncn4)C(=O)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C23H25N5O3
All Atoms:56
Heavy Atoms:31
Chiral Atoms:2
ZAP Information [?]
Total:9.86022
Area:640.875
Solvation:-6.16164
Coulombic:-63.994
Bond Count [?]
All:34
Single:24
Double:10
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:419.477
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:2.94
LogP (Chemaxon):2.42

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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