Chemical ID: 6602517

Cc1cccc(c1)NC(=O)COC(=O)c2ccc(cc2)NC(=O)C
Chemical ID:
6602517
Name [?]:
m-tolylcarbamoylmethyl 4-acetamidobenzoate
SMILES [?]:
Cc1cccc(c1)NC(=O)COC(=O)c2ccc(cc2)NC(=O)C
InChi [?]:
InChI=1/C18H18N2O4/c1-12-4-3-5-16(10-12)20-17(22)11-24-18(23)14-6-8-15(9-7-14)19-13(2)21/h3-10H,11H2,1-2H3,(H,19,21)(H,20,22)
InChi Info:
AuxInfo=1/1/N:1,24,4,3,5,16,20,17,19,7,11,2,22,15,18,6,9,13,21,8,23,10,14,12/E:(6,7)(8,9)/rA:24nCCCCCCCNCOCOCOCCCCCCNCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;d9;s9;s11;s12;d13;s13;s15;d16;s17;d18;d15s19;s18;s21;d22;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H18N2O4
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:9.4143
Area:559.922
Solvation:-4.58374
Coulombic:-59.6002
Bond Count [?]
All:25
Single:16
Double:9
Rotors:8
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:326.347
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:2.39
LogP (Chemaxon):2.47

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