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24849-97-6 | 1,3,5-Triazine-2,4-diamine, 1,6-dihydro-6,6-dimethyl-1-(2-naphthalenyl)-
CAS No: 24849-97-6 Catalog No: AG002PML MDL No:
Product Description
Catalog Number:
AG002PML
Chemical Name:
1,3,5-Triazine-2,4-diamine, 1,6-dihydro-6,6-dimethyl-1-(2-naphthalenyl)-
CAS Number:
24849-97-6
Molecular Formula:
C15H17N5
Molecular Weight:
267.3290
IUPAC Name:
6,6-dimethyl-1-naphthalen-2-yl-1,3,5-triazine-2,4-diamine
InChI:
InChI=1S/C15H17N5/c1-15(2)19-13(16)18-14(17)20(15)12-8-7-10-5-3-4-6-11(10)9-12/h3-9H,1-2H3,(H4,16,17,18,19)
InChI Key:
HVUMULOFKBCXQE-UHFFFAOYSA-N
SMILES:
NC1=NC(N(C(=N1)N)c1ccc2c(c1)cccc2)(C)C
Properties
Complexity:
440
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.148g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
267.336g/mol
Monoisotopic Mass:
267.148g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
Literature
| Title | Journal |
|---|---|
| Pneumocystis carinii dihydrofolate reductase used to screen potential antipneumocystis drugs. | Antimicrobial agents and chemotherapy 19910701 |
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