Chemical ID: 7289699

CC(C)c1ccc(cc1)NC(=O)COc2ccccc2C(=O)N
Chemical ID:
7289699
Name [?]:
2-[(4-isopropylphenyl)carbamoylmethoxy]benzamide
SMILES [?]:
CC(C)c1ccc(cc1)NC(=O)COc2ccccc2C(=O)N
InChi [?]:
InChI=1/C18H20N2O3/c1-12(2)13-7-9-14(10-8-13)20-17(21)11-23-16-6-4-3-5-15(16)18(19)22/h3-10,12H,11H2,1-2H3,(H2,19,22)(H,20,21)
InChi Info:
AuxInfo=1/1/N:1,3,18,17,19,16,5,9,6,8,13,2,4,7,20,15,11,21,23,10,12,22,14/E:(1,2)(7,8)(9,10)/rA:23nCCCCCCCCCNCOCOCCCCCCCON/rB:s1;s2;s2;s4;d5;s6;d7;d4s8;s7;s10;d11;s11;s13;s14;s15;d16;s17;d18;d15s19;s20;d21;s21;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C18H20N2O3
All Atoms:43
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:7.27933
Area:532.53
Solvation:-6.03393
Coulombic:-53.2937
Bond Count [?]
All:24
Single:16
Double:8
Rotors:7
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:312.363
H-Bond Donors:3
H-Bond Acceptors:5
XLogP:2.97
LogP (Chemaxon):2.72

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Descriptor Annotations

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