Chemical ID: 4730654

CCc1nc2ccccc2c(=O)n1N
Chemical ID:
4730654
Name [?]:
3-amino-2-ethyl-quinazolin-4-one
SMILES [?]:
CCc1nc2ccccc2c(=O)n1N
InChi [?]:
InChI=1/C10H11N3O/c1-2-9-12-8-6-4-3-5-7(8)10(14)13(9)11/h3-6H,2,11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,2,8,7,9,6,10,5,3,11,14,4,13,12/rA:14nCCCNCCCCCCCONN/rB:s1;s2;d3;s4;s5;d6;s7;d8;d5s9;s10;d11;s3s11;s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H11N3O
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:7.10691
Area:347.305
Solvation:-1.57571
Coulombic:-33.553
Bond Count [?]
All:15
Single:10
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:189.214
H-Bond Donors:2
H-Bond Acceptors:2
XLogP:0.51
LogP (Chemaxon):1.01

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Experimental Annotations

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Descriptor Annotations

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