Name: Name:2-chloro-N-[3-cyano-1-(oxolan-2-ylmethyl)-4,5,6,7-tetrahydro-1H-indol-2-yl]acetamide
Brand: Angene
SKU: AG019N4M
Rating: 90 (10 reviews)

2-chloro-N-[3-cyano-1-(oxolan-2-ylmethyl)-4,5,6,7-tetrahydro-1H-indol-2-yl]acetamide

CAS No.:

1087784-66-4

Catalog Number:

AG019N4M

Molecular Formula:

C16H20ClN3O2

Molecular Weight:

321.8019

Catalog Number:

AG019N4M

Chemical Name:

2-chloro-N-[3-cyano-1-(oxolan-2-ylmethyl)-4,5,6,7-tetrahydro-1H-indol-2-yl]acetamide

CAS Number:

1087784-66-4

Molecular Formula:

C16H20ClN3O2

Molecular Weight:

321.8019

MDL Number:

MFCD11505428

IUPAC Name:

2-chloro-N-[3-cyano-1-(oxolan-2-ylmethyl)-4,5,6,7-tetrahydroindol-2-yl]acetamide

InChI:

InChI=1S/C16H20ClN3O2/c17-8-15(21)19-16-13(9-18)12-5-1-2-6-14(12)20(16)10-11-4-3-7-22-11/h11H,1-8,10H2,(H,19,21)

InChI Key:

NRUFLRSCJADFRI-UHFFFAOYSA-N

SMILES:

ClCC(=O)Nc1c(C#N)c2c(n1CC1CCCO1)CCCC2

Complexity:

464

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

321.124g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

321.805g/mol

Monoisotopic Mass:

321.124g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

67A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.6