Chemical ID: 4693598

c1ccc2c(c1)c(c[nH]2)CCNc3ccc(nn3)Cl
Chemical ID:
4693598
Name [?]:
6-chloro-N-[2-(1H-indol-3-yl)ethyl]pyridazin-3-amine
SMILES [?]:
c1ccc2c(c1)c(c[nH]2)CCNc3ccc(nn3)Cl
InChi [?]:
InChI=1/C14H13ClN4/c15-13-5-6-14(19-18-13)16-8-7-10-9-17-12-4-2-1-3-11(10)12/h1-6,9,17H,7-8H2,(H,16,19)
InChi Info:
AuxInfo=1/1/N:1,2,6,3,15,14,10,11,8,7,5,4,16,13,19,12,9,17,18/rA:19nCCCCCCCCNCCNCCCCNNCl/rB:s1;d2;s3;d4;d1s5;s5;d7;s4s8;s7;s10;s11;s12;s13;d14;s15;d16;d13s17;s16;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H13ClN4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.66079
Area:473.75
Solvation:-2.18296
Coulombic:-28.3016
Bond Count [?]
All:21
Single:14
Double:7
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:272.733
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:2.96
LogP (Chemaxon):3.0

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