Name: Name:4-Boc-1-[(4-bromobenzene)sulfonyl]homopiperazine
Brand: Angene
SKU: AG00GUXE
Rating: 90 (10 reviews)

4-Boc-1-[(4-bromobenzene)sulfonyl]homopiperazine

CAS No.:

937012-68-5

Catalog Number:

AG00GUXE

Molecular Formula:

C16H23BrN2O4S

Molecular Weight:

419.3338

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

1 week

United States

$150

- +

1 week

United States

$484

- +

Catalog Number:

AG00GUXE

Chemical Name:

4-Boc-1-[(4-bromobenzene)sulfonyl]homopiperazine

CAS Number:

937012-68-5

Molecular Formula:

C16H23BrN2O4S

Molecular Weight:

419.3338

MDL Number:

MFCD18915052

IUPAC Name:

tert-butyl 4-(4-bromophenyl)sulfonyl-1,4-diazepane-1-carboxylate

InChI:

InChI=1S/C16H23BrN2O4S/c1-16(2,3)23-15(20)18-9-4-10-19(12-11-18)24(21,22)14-7-5-13(17)6-8-14/h5-8H,4,9-12H2,1-3H3

InChI Key:

RWITZYGOTODACS-UHFFFAOYSA-N

SMILES:

Brc1ccc(cc1)S(=O)(=O)N1CCCN(CC1)C(=O)OC(C)(C)C

Complexity:

533

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

418.056g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

419.334g/mol

Monoisotopic Mass:

418.056g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

75.3A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8