Name: Name:tert-Butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-5,6-dihydropyridine-1(2H)-carboxylate
Brand: Angene
SKU: AG019FU1
Rating: 90 (10 reviews)

tert-Butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-5,6-dihydropyridine-1(2H)-carboxylate

CAS No.:

400801-82-3

Catalog Number:

AG019FU1

Molecular Formula:

C17H21N3O2

Molecular Weight:

299.3675

Catalog Number:

AG019FU1

Chemical Name:

tert-Butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-5,6-dihydropyridine-1(2H)-carboxylate

CAS Number:

400801-82-3

Molecular Formula:

C17H21N3O2

Molecular Weight:

299.3675

MDL Number:

MFCD11499032

IUPAC Name:

tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate

InChI:

InChI=1S/C17H21N3O2/c1-17(2,3)22-16(21)20-9-6-12(7-10-20)14-11-19-15-13(14)5-4-8-18-15/h4-6,8,11H,7,9-10H2,1-3H3,(H,18,19)

InChI Key:

XROZMXLDMSBVFX-UHFFFAOYSA-N

SMILES:

O=C(N1CCC(=CC1)c1c[nH]c2c1cccn2)OC(C)(C)C

Complexity:

455

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.163g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

299.374g/mol

Monoisotopic Mass:

299.163g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

58.2A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.4