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Chemical ID: 4543716
Chemical ID:
4543716
Name [?]:
6-methoxy-4-methyl-quinazolin-2-amine
SMILES [?]:
Cc1c2cc(ccc2nc(n1)N)OC
InChi [?]:
InChI=1/C10H11N3O/c1-6-8-5-7(14-2)3-4-9(8)13-10(11)12-6/h3-5H,1-2H3,(H2,11,12,13)
InChi Info:
AuxInfo=1/1/N:1,14,6,7,4,2,5,3,8,10,12,11,9,13/rA:14nCCCCCCCCNCNNOC/rB:s1;s2;s3;d4;s5;d6;d3s7;s8;d9;d2s10;s10;s5;s13;/rC:;;;;;;;;;;;;;;
Chemical Details
Atom Count
Formula: | C10H11N3O |
All Atoms: | 14 |
Heavy Atoms: | 14 |
Chiral Atoms: | 0 |
ZAP Information [?]
Total: | 6.16229 |
Area: | 348.154 |
Solvation: | -2.54155 |
Coulombic: | -34.6801 |
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: | 1.23 |
LogP (Chemaxon): | 1.13 |
Name Annotations
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Experimental Annotations
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Descriptor Annotations
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