Chemical ID: 4692819

Cc1cc(ccc1Nc2c3cc(c(cc3ncn2)OC)OC)OC
Chemical ID:
4692819
Name [?]:
6,7-dimethoxy-N-(4-methoxy-2-methyl-phenyl)-quinazolin-4-amine
SMILES [?]:
Cc1cc(ccc1Nc2c3cc(c(cc3ncn2)OC)OC)OC
InChi [?]:
InChI=1/C18H19N3O3/c1-11-7-12(22-2)5-6-14(11)21-18-13-8-16(23-3)17(24-4)9-15(13)19-10-20-18/h5-10H,1-4H3,(H,19,20,21)
InChi Info:
AuxInfo=1/1/N:1,24,22,20,5,6,3,11,14,17,2,4,10,7,15,12,13,9,16,18,8,23,21,19/rA:24nCCCCCCCNCCCCCCCNCNOCOCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s8;s9;s10;d11;s12;d13;d10s14;s15;d16;d9s17;s13;s19;s12;s21;s4;s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H19N3O3
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:6.66444
Area:518.57
Solvation:-6.29982
Coulombic:-41.9515
Bond Count [?]
All:26
Single:18
Double:8
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:325.362
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:2.73
LogP (Chemaxon):2.97

Name Annotations

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Descriptor Annotations

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