Chemical ID: 4260504

c1cc(cc2c1cc3ccc(cc3[nH+]2)N)N
Chemical ID:
4260504
Name [?]:
10H-acridine-3,6-diamine
SMILES [?]:
c1cc(cc2c1cc3ccc(cc3[nH+]2)N)N
InChi [?]:
InChI=1/C13H11N3/c14-10-3-1-8-5-9-2-4-11(15)7-13(9)16-12(8)6-10/h1-7H,14-15H2/p+1
InChi Info:
AuxInfo=1/1/N:1,9,2,10,7,4,12,6,8,3,11,5,13,16,15,14/E:(1,2)(3,4)(6,7)(8,9)(10,11)(12,13)(14,15)/rA:16nCCCCCCCCCCCCCN+NN/rB:s1;d2;s3;d4;d1s5;s6;d7;s8;d9;s10;d11;s8s12;s5d13;s11;s3;/rC:;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H12N3+
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:-21.4559
Area:376.64
Solvation:-30.8719
Coulombic:-27.8633
Bond Count [?]
All:18
Single:11
Double:7
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:210.255
H-Bond Donors:4
H-Bond Acceptors:2
XLogP:1.42
LogP (Chemaxon):1.97

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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