Chemical ID: 5168169

CCOC(=O)c1nc2ccccc2c(n1)O
Chemical ID:
5168169
Name [?]:
ethyl 4-hydroxyquinazoline-2-carboxylate
SMILES [?]:
CCOC(=O)c1nc2ccccc2c(n1)O
InChi [?]:
InChI=1/C11H10N2O3/c1-2-16-11(15)9-12-8-6-4-3-5-7(8)10(14)13-9/h3-6H,2H2,1H3,(H,12,13,14)
InChi Info:
AuxInfo=1/1/N:1,2,11,10,12,9,13,8,6,14,4,7,15,16,5,3/rA:16nCCOCOCNCCCCCCCNO/rB:s1;s2;s3;d4;s4;s6;d7;s8;d9;s10;d11;s8s12;d13;d6s14;s14;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H10N2O3
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:7.38146
Area:395.617
Solvation:-2.50898
Coulombic:-50.8701
Bond Count [?]
All:17
Single:11
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:218.209
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.85
LogP (Chemaxon):2.77

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