Chemical ID: 4166459

Cc1cccc(c1)Nc2cc(=O)n(c(=O)n2C)C
Chemical ID:
4166459
Name [?]:
1,3-dimethyl-6-(m-tolylamino)pyrimidine-2,4-dione
SMILES [?]:
Cc1cccc(c1)Nc2cc(=O)n(c(=O)n2C)C
InChi [?]:
InChI=1/C13H15N3O2/c1-9-5-4-6-10(7-9)14-11-8-12(17)16(3)13(18)15(11)2/h4-8,14H,1-3H3
InChi Info:
AuxInfo=1/0/N:1,17,18,4,3,5,7,10,2,6,9,11,14,8,16,13,12,15/rA:18nCCCCCCCNCCCONCONCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s10;d11;s11;s13;d14;s9s14;s16;s13;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H15N3O2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.47757
Area:423.149
Solvation:-2.10114
Coulombic:-45.9981
Bond Count [?]
All:19
Single:13
Double:6
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:245.277
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:1.55
LogP (Chemaxon):1.9

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Descriptor Annotations

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