Chemical ID: 6602533

Cc1cc(cc(c1)NC(=O)COC(=O)c2ccc(cc2)NC(=O)C)C
Chemical ID:
6602533
Name [?]:
(3,5-dimethylphenyl)carbamoylmethyl 4-acetamidobenzoate
SMILES [?]:
Cc1cc(cc(c1)NC(=O)COC(=O)c2ccc(cc2)NC(=O)C)C
InChi [?]:
InChI=1/C19H20N2O4/c1-12-8-13(2)10-17(9-12)21-18(23)11-25-19(24)15-4-6-16(7-5-15)20-14(3)22/h4-10H,11H2,1-3H3,(H,20,22)(H,21,23)
InChi Info:
AuxInfo=1/1/N:1,25,24,16,20,17,19,3,7,5,11,2,4,22,15,18,6,9,13,21,8,23,10,14,12/E:(1,2)(4,5)(6,7)(9,10)(12,13)/rA:25nCCCCCCCNCOCOCOCCCCCCNCOCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;d13;s13;s15;d16;s17;d18;d15s19;s18;s21;d22;s22;s4;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H20N2O4
All Atoms:25
Heavy Atoms:25
Chiral Atoms:0
ZAP Information [?]
Total:10.0001
Area:582.124
Solvation:-4.55299
Coulombic:-59.3774
Bond Count [?]
All:26
Single:17
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:340.373
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:2.82
LogP (Chemaxon):2.94

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Descriptor Annotations

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