Chemical ID: 6422378

Cc1ccc(cc1)c2c(c([nH]n2)N)N=Nc3ccc(cc3)OC
Chemical ID:
6422378
Name [?]:
4-(4-methoxyphenyl)azo-5-(p-tolyl)-2H-pyrazol-3-amine
SMILES [?]:
Cc1ccc(cc1)c2c(c([nH]n2)N)N=Nc3ccc(cc3)OC
InChi [?]:
InChI=1/C17H17N5O/c1-11-3-5-12(6-4-11)15-16(17(18)22-20-15)21-19-13-7-9-14(23-2)10-8-13/h3-10H,1-2H3,(H3,18,20,22)
InChi Info:
AuxInfo=1/1/N:1,23,3,7,4,6,17,21,18,20,2,5,16,19,8,9,10,13,15,12,14,11,22/E:(3,4)(5,6)(7,8)(9,10)/rA:23nCCCCCCCCCCNNNNNCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;d9;s10;d8s11;s10;s9;w14;s15;s16;d17;s18;d19;d16s20;s19;s22;/rC:;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H17N5O
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:8.4274
Area:462.757
Solvation:-3.14153
Coulombic:-40.0629
Bond Count [?]
All:25
Single:16
Double:9
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:307.35
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:5.12
LogP (Chemaxon):4.13

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