Name: Name:8-(3-(4-acryloylpiperazin-1-yl)propyl)-6-(2,6-dichloro-3,5-dimethoxyphenyl)-2-(methylamino)pyrido[2,3-d]pyrimidin-7(8H)-one
Brand: Angene
SKU: AG01DH0S
Rating: 90 (10 reviews)

8-(3-(4-acryloylpiperazin-1-yl)propyl)-6-(2,6-dichloro-3,5-dimethoxyphenyl)-2-(methylamino)pyrido[2,3-d]pyrimidin-7(8H)-one

CAS No.:

1802929-43-6

Catalog Number:

AG01DH0S

Molecular Formula:

C26H30Cl2N6O4

Molecular Weight:

561.4602

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

1mg

99%

1 week

United States

$182

- +

5mg

99%

1 week

United States

$473

- +

10mg

99%

1 week

United States

$751

- +

50mg

99%

1 week

United States

$2140

- +

100mg

99%

1 week

United States

$2973

- +

Product Description

Catalog Number:

AG01DH0S

Chemical Name:

8-(3-(4-acryloylpiperazin-1-yl)propyl)-6-(2,6-dichloro-3,5-dimethoxyphenyl)-2-(methylamino)pyrido[2,3-d]pyrimidin-7(8H)-one

CAS Number:

1802929-43-6

Molecular Formula:

C26H30Cl2N6O4

Molecular Weight:

561.4602

MDL Number:

MFCD31560471

IUPAC Name:

6-(2,6-dichloro-3,5-dimethoxyphenyl)-2-(methylamino)-8-[3-(4-prop-2-enoylpiperazin-1-yl)propyl]pyrido[2,3-d]pyrimidin-7-one

InChI:

InChI=1S/C26H30Cl2N6O4/c1-5-20(35)33-11-9-32(10-12-33)7-6-8-34-24-16(15-30-26(29-2)31-24)13-17(25(34)36)21-22(27)18(37-3)14-19(38-4)23(21)28/h5,13-15H,1,6-12H2,2-4H3,(H,29,30,31)

InChI Key:

PUIXMSRTTHLNKI-UHFFFAOYSA-N

SMILES:

C=CC(=O)N1CCN(CC1)CCCn1c2nc(NC)ncc2cc(c1=O)c1c(Cl)c(OC)cc(c1Cl)OC

UNII:

S3OPE9IA3Q

Properties

Complexity:

870

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

560.171g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

561.464g/mol

Monoisotopic Mass:

560.171g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

100A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

3.5

Literature

Title	Journal
Discovery of the Irreversible Covalent FGFR Inhibitor 8-(3-(4-Acryloylpiperazin-1-yl)propyl)-6-(2,6-dichloro-3,5-dimethoxyphenyl)-2-(methylamino)pyrido[2,3-d]pyrimidin-7(8H)-one (PRN1371) for the Treatment of Solid Tumors.	Journal of medicinal chemistry 20170810