Name: Name:Plx647
Brand: Angene
SKU: AG00GU5M
Rating: 90 (10 reviews)

Plx647

CAS No.:

873786-09-5

Catalog Number:

AG00GU5M

Molecular Formula:

C21H17F3N4

Molecular Weight:

382.3817

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

5mg

98%

1 week

United States

$140

- +

10mg

98%

1 week

United States

$182

- +

50mg

98%

1 week

United States

$404

- +

100mg

98%

1 week

United States

$682

- +

Catalog Number:

AG00GU5M

Chemical Name:

Plx647

CAS Number:

873786-09-5

Molecular Formula:

C21H17F3N4

Molecular Weight:

382.3817

MDL Number:

MFCD28100808

IUPAC Name:

5-(1H-pyrrolo[2,3-b]pyridin-3-ylmethyl)-N-[[4-(trifluoromethyl)phenyl]methyl]pyridin-2-amine

InChI:

InChI=1S/C21H17F3N4/c22-21(23,24)17-6-3-14(4-7-17)11-26-19-8-5-15(12-27-19)10-16-13-28-20-18(16)2-1-9-25-20/h1-9,12-13H,10-11H2,(H,25,28)(H,26,27)

InChI Key:

NODCQQSEMCESEC-UHFFFAOYSA-N

SMILES:

FC(c1ccc(cc1)CNc1ccc(cn1)Cc1c[nH]c2c1cccn2)(F)F

Complexity:

493

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

382.141g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

382.39g/mol

Monoisotopic Mass:

382.141g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

53.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

4.9