Chemical ID: 7498392

CC(C)Oc1ccc(cc1)C(=O)Nc2ccc(c(c2)Cl)Cl
Chemical ID:
7498392
Name [?]:
N-(3,4-dichlorophenyl)-4-isopropoxy-benzamide
SMILES [?]:
CC(C)Oc1ccc(cc1)C(=O)Nc2ccc(c(c2)Cl)Cl
InChi [?]:
InChI=1/C16H15Cl2NO2/c1-10(2)21-13-6-3-11(4-7-13)16(20)19-12-5-8-14(17)15(18)9-12/h3-10H,1-2H3,(H,19,20)
InChi Info:
AuxInfo=1/1/N:1,3,7,9,15,6,10,16,19,2,8,14,5,17,18,11,21,20,13,12,4/E:(1,2)(3,4)(6,7)/rA:21nCCCOCCCCCCCONCCCCCCClCl/rB:s1;s2;s2;s4;s5;d6;s7;d8;d5s9;s8;d11;s11;s13;s14;d15;s16;d17;d14s18;s18;s17;/rC:;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C16H15Cl2NO2
All Atoms:36
Heavy Atoms:21
Chiral Atoms:0
ZAP Information [?]
Total:10.2716
Area:523.486
Solvation:-2.81553
Coulombic:-30.7114
Bond Count [?]
All:22
Single:15
Double:7
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:324.201
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:5.03
LogP (Chemaxon):4.64

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Descriptor Annotations

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