Chemical ID: 6472847

CC1CN(C(=O)NC1=O)c2ccc(cc2)N(C)C
Chemical ID:
6472847
Name [?]:
1-(4-dimethylaminophenyl)-5-methyl-hexahydropyrimidine-2,4-dione
SMILES [?]:
CC1CN(C(=O)NC1=O)c2ccc(cc2)N(C)C
InChi [?]:
InChI=1/C13H17N3O2/c1-9-8-16(13(18)14-12(9)17)11-6-4-10(5-7-11)15(2)3/h4-7,9H,8H2,1-3H3,(H,14,17,18)
InChi Info:
AuxInfo=1/1/N:1,17,18,12,14,11,15,3,2,13,10,8,5,7,16,4,9,6/E:(2,3)(4,5)(6,7)/rA:18cCCCNCONCOCCCCCCNCC/rB:s1;s2;s3;s4;d5;s5;s2s7;d8;s4;s10;d11;s12;d13;d10s14;s13;s16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H17N3O2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:1
ZAP Information [?]
Total:7.73074
Area:427.866
Solvation:-2.96591
Coulombic:-43.5285
Bond Count [?]
All:19
Single:14
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:247.293
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:1.05
LogP (Chemaxon):1.59

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