Ethyl {2-amino-6-[(4-fluorobenzyl)amino]-3-pyridinyl}carbamate (2Z)-2-butenedioate (1:1) | CAS No. 75507-68-5

Ethyl {2-amino-6-[(4-fluorobenzyl)amino]-3-pyridinyl}carbamate (2Z)-2-butenedioate (1:1)

Basic Information

CAS Number

75507-68-5

Molecular Formula

C19H21FN4O6

Molecular Weight

420.4 g/mol

AD

Basic Physical Properties

Melting Point

177°C

Boiling Point

434.9 °C at 760 mmHg

Density

1.35

Flash Point

216.8 °C

Solubility

DMSO: soluble >20mg/mL

CCOC(=O)NC1=C(N=C(C=C1)NCC2=CC=C(C=C2)F)N.C(=CC(=O)O)C(=O)O

InChI

InChI=1S/C15H17FN4O2.C4H4O4/c1-2-22-15(21)19-12-7-8-13(20-14(12)17)18-9-10-3-5-11(16)6-4-10;5-3(6)1-2-4(7)8/h3-8H,2,9H2,1H3,(H,19,21)(H3,17,18,20);1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

DPYIXBFZUMCMJM-BTJKTKAUSA-N

LogP

2.6952000000000007

Topological Polar Surface Area

163.87 Ų

Hydrogen Bond Donor/Acceptor

6 / 10

Complexity

469

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Synonyms & References

English

  • Carbamic acid, [2-amino-6-[[(4-fluorophenyl)methyl]amino]-3-pyridinyl]-, ethyl ester, (Z)-2-butenedioate (1:1)
  • 0VCI53PK4A
  • NCGC00015451-03
  • Ethyl 2-amino-6-((p-fluorobenzyl)amino)-3-pyridinecarbamate maleate (1:1)
  • Tox21_111232_1
  • NCGC00093935-02
  • EU-0100547
  • 75507-68-5
  • D-9998
  • DTXSID8045771
  • MFCD00941415
  • Tox21_113397
  • CAS-75507-68-5
  • BCP9000699
  • Effirma
  • Flupirtine maleate salt, >=98% (HPLC)
  • Flupirtine maleate
  • SR-01000075887-1
  • Flupirtine maleate (USAN)
  • Ethyl-N-(2-amino-6-(4-fluor-phenylmethylamino)pyridin-3-yl)carbamat maleat [German]
  • Q27231153
  • 2-amino-6-[[(4-fluorophenyl)methyl]amino]-3-pyridinyl]-carbamic acid, ethyl ester maleate
  • (2-Amino-6-(((4-fluorophenyl)methyl)amino)-3-pyridinyl)carbamic acid ethyl ester maleate
  • Flupirtine maleate [USAN]
  • DTXCID6025771
  • Tox21_500547
  • AC-454
  • ETHYL (2-AMINO-6-((4-FLUOROBENZYL)AMINO)PYRIDIN-3-YL)CARBAMATE MALEATE
  • FLUPIRTINE MALEATE [VANDF]
  • Flupirtin-maleat
  • Flupirtinmaleat

MDL Number

MFCD00941415

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