Chemical ID: 6762057

c1cc(ccc1COc2ccc(cc2Cl)Br)C(=O)NN
Chemical ID:
6762057
Name [?]:
4-[(4-bromo-2-chloro-phenoxy)methyl]benzohydrazide
SMILES [?]:
c1cc(ccc1COc2ccc(cc2Cl)Br)C(=O)NN
InChi [?]:
InChI=1/C14H12BrClN2O2/c15-11-5-6-13(12(16)7-11)20-8-9-1-3-10(4-2-9)14(19)18-17/h1-7H,8,17H2,(H,18,19)
InChi Info:
AuxInfo=1/1/N:1,5,2,4,11,10,13,7,6,3,12,14,9,17,16,15,20,19,18,8/E:(1,2)(3,4)/rA:20nCCCCCCCOCCCCCCClBrCONN/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;s9;d10;s11;d12;d9s13;s14;s12;s3;d17;s17;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H12BrClN2O2
All Atoms:32
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:8.73577
Area:508.159
Solvation:-3.9682
Coulombic:-37.1794
Bond Count [?]
All:21
Single:14
Double:7
Rotors:5
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:355.614
H-Bond Donors:3
H-Bond Acceptors:4
XLogP:3.47
LogP (Chemaxon):3.52

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