Name: Name:2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(naphthalen-2-yl)acetic acid
Brand: Angene
SKU: AG0089GH
Rating: 90 (10 reviews)

2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(naphthalen-2-yl)acetic acid

CAS No.:

885274-80-6

Catalog Number:

AG0089GH

Molecular Formula:

C21H26N2O4

Molecular Weight:

370.4421

Catalog Number:

AG0089GH

Chemical Name:

2-(4-(tert-Butoxycarbonyl)piperazin-1-yl)-2-(naphthalen-2-yl)acetic acid

CAS Number:

885274-80-6

Molecular Formula:

C21H26N2O4

Molecular Weight:

370.4421

MDL Number:

MFCD04115154

IUPAC Name:

2-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-2-naphthalen-2-ylacetic acid

InChI:

InChI=1S/C21H26N2O4/c1-21(2,3)27-20(26)23-12-10-22(11-13-23)18(19(24)25)17-9-8-15-6-4-5-7-16(15)14-17/h4-9,14,18H,10-13H2,1-3H3,(H,24,25)

InChI Key:

VCKNXQIHLAMSSE-UHFFFAOYSA-N

SMILES:

OC(=O)C(c1ccc2c(c1)cccc2)N1CCN(CC1)C(=O)OC(C)(C)C

Complexity:

537

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

370.189g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

370.449g/mol

Monoisotopic Mass:

370.189g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

70.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.2