Chemical ID: 3967067

c1cc(c(cc1Cl)c2nc(nc(n2)N)N)Cl
Chemical ID:
3967067
Name [?]:
6-(2,5-dichlorophenyl)-1,3,5-triazine-2,4-diamine
SMILES [?]:
c1cc(c(cc1Cl)c2nc(nc(n2)N)N)Cl
InChi [?]:
InChI=1/C9H7Cl2N5/c10-4-1-2-6(11)5(3-4)7-14-8(12)16-9(13)15-7/h1-3H,(H4,12,13,14,15,16)
InChi Info:
AuxInfo=1/1/N:1,2,5,6,4,3,8,10,12,7,16,15,14,9,13,11/E:(8,9)(12,13)(14,15)/rA:16nCCCCCCClCNCNCNNNCl/rB:s1;d2;s3;d4;d1s5;s6;s4;s8;d9;s10;d11;d8s12;s12;s10;s3;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C9H7Cl2N5
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:8.99741
Area:410.324
Solvation:-1.26068
Coulombic:-52.9606
Bond Count [?]
All:17
Single:11
Double:6
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:256.091
H-Bond Donors:4
H-Bond Acceptors:2
XLogP:1.99
LogP (Chemaxon):2.45

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Descriptor Annotations

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