Chemical ID: 4193052

CC(C)NC(=O)C(=O)NCc1ccc2c(c1)OCO2
Chemical ID:
4193052
Name [?]:
N'-(benzo[1,3]dioxol-5-ylmethyl)-N-isopropyl-oxamide
SMILES [?]:
CC(C)NC(=O)C(=O)NCc1ccc2c(c1)OCO2
InChi [?]:
InChI=1/C13H16N2O4/c1-8(2)15-13(17)12(16)14-6-9-3-4-10-11(5-9)19-7-18-10/h3-5,8H,6-7H2,1-2H3,(H,14,16)(H,15,17)
InChi Info:
AuxInfo=1/1/N:1,3,12,13,16,10,18,2,11,14,15,7,5,9,4,8,6,19,17/E:(1,2)/rA:19nCCCNCOCONCCCCCCCOCO/rB:s1;s2;s2;s4;d5;s5;d7;s7;s9;s10;s11;d12;s13;d14;d11s15;s15;s17;s14s18;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H16N2O4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.4688
Area:471.041
Solvation:-3.30722
Coulombic:-63.3969
Bond Count [?]
All:20
Single:15
Double:5
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:264.277
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:1.24
LogP (Chemaxon):0.74

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