Name: Name:6-tert-butyl-3-(4-methylbenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine
Brand: Angene
SKU: AG019NO3
Rating: 90 (10 reviews)

6-tert-butyl-3-(4-methylbenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine

CAS No.:

793716-16-2

Catalog Number:

AG019NO3

Molecular Formula:

C20H25NOS

Molecular Weight:

327.4836

Catalog Number:

AG019NO3

Chemical Name:

6-tert-butyl-3-(4-methylbenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine

CAS Number:

793716-16-2

Molecular Formula:

C20H25NOS

Molecular Weight:

327.4836

MDL Number:

MFCD06364481

IUPAC Name:

(2-amino-6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-(4-methylphenyl)methanone

InChI:

InChI=1S/C20H25NOS/c1-12-5-7-13(8-6-12)18(22)17-15-10-9-14(20(2,3)4)11-16(15)23-19(17)21/h5-8,14H,9-11,21H2,1-4H3

InChI Key:

KPVAMJRCFGIMAY-UHFFFAOYSA-N

SMILES:

Cc1ccc(cc1)C(=O)c1c(N)sc2c1CCC(C2)C(C)(C)C

Complexity:

435

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

327.166g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

327.486g/mol

Monoisotopic Mass:

327.166g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

6.4