Name: Name:6,6-dimethyl-3-(4-methylbenzoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-amine
Brand: Angene
SKU: AG01A6PJ
Rating: 90 (10 reviews)

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

CAS No.:

1461715-47-8

Catalog Number:

AG01A6PJ

Molecular Formula:

C18H21NOS

Molecular Weight:

299.4304

Catalog Number:

AG01A6PJ

Chemical Name:

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

CAS Number:

1461715-47-8

Molecular Formula:

C18H21NOS

Molecular Weight:

299.4304

MDL Number:

MFCD26407605

IUPAC Name:

(2-amino-6,6-dimethyl-5,7-dihydro-4H-1-benzothiophen-3-yl)-(4-methylphenyl)methanone

InChI:

InChI=1S/C18H21NOS/c1-11-4-6-12(7-5-11)16(20)15-13-8-9-18(2,3)10-14(13)21-17(15)19/h4-7H,8-10,19H2,1-3H3

InChI Key:

YLLLRGILMRXIMY-UHFFFAOYSA-N

SMILES:

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

Complexity:

400

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

299.134g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

299.432g/mol

Monoisotopic Mass:

299.134g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

71.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

5.6