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BIBX 1382 DIHYDROCHLORIDE

BIBX 1382 DIHYDROCHLORIDE structure

CAS No:
196612-93-8
Formula:
C18H21Cl3FN7
Chemical Name:
BIBX 1382 DIHYDROCHLORIDE
Synonyms:
N8-(3-CHLORO-4-FLUOROPHENYL)-N2-(1-METHYL-4-PIPERIDINYL)-PYRIMIDO[5,4-D]PYRIMIDINE-2,8-DIAMINE DIHYDROCHLORIDE;BIBX 1382 DIHYDROCHLORIDE;8-(3-Chloro-4-fluoroanilino)-2-((1-methyl-4-piperidyl)amino)pyrimido(5,4-D)pyrimidine;Falnidamol;Falnidamol [inn];Pyrimido(5,4-D)pyrimidine-2,8-diamine, N8-(3-chloro-4-fluorophenyl)-N2-(1-methyl-4-piperidinyl)-;Unii-0mu316797d;N8-(3-Chloro-4-fluorophenyl)-N2-(1-methyl-4-piperidinyl)-pyrimido[5,4-d]pyrimidine-2,8-diaminedihydrochloride

Description

Falnidamol (BIBX 1382) is a potent, selective inhibitor of EGFR tyrosine kinase (IC50 = 3 nM); displays > 1000-fold lower potency against ErbB2 (IC50 = 3.4 μM) and a range of other related tyrosine kinases (IC50 > 10 μM).

N4-(3-chloro-4-fluorophenyl)-N6-(1-methyl-4-piperidinyl)pyrimido[5,4-d]pyrimidine-4,6-diamine is a substituted aniline.|Falnidamol has been used in trials studying the treatment of Unspecified Adult Solid Tumor, Protocol Specific.

BIBX 1382 DIHYDROCHLORIDE Basic Attributes

Molecular Weight：

460.7636432

Exact Mass：

387.137

UNII：

0MU316797D

DSSTox ID：

DTXSID0048399

Characteristics

PSA：

78.86000

XLogP3：

5.14990

Density：

1.427

Boiling Point：

552.0±60.0 °C(Predicted)

Flash Point：

313.1ºC

Refractive Index：

1.7

Storage Conditions：

Desiccate at +4°C

Drug Information

MeSH Entry Terms：

BIBX 1382BS

BIBX 1382 DIHYDROCHLORIDE Use and Manufacturing

Potent, selective inhibitor of epidermal growth factor receptor (EGFR) tyrosine kinase (IC 50 = 3 nM). Displays > 1000-fold lower potency against ErbB2 (IC 50 = 3.4 μ M) and a range of other related tyrosine kinases (IC 50 > 10 μ M). Oral administration inhibits growth of established human xenografts in athymic mice.

Computed Properties

Molecular Weight:387.8
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:387.1374495
Monoisotopic Mass:387.1374495
Topological Polar Surface Area:78.9
Heavy Atom Count:27
Complexity:479
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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BIBX 1382 DIHYDROCHLORIDE

CAS No.: 196612-93-8

Content: 99.00%

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Guide of BIBX 1382 DIHYDROCHLORIDE

Description
Basic Attributes
Characteristics
Drug Information
Use and Manufacturing
Computed Properties
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