80741-39-5 | Boc-3,4-dichloro-l-phenylalanine

Packsize	Purity	Availability	Price	Discounted Price
250mg	97%	in stock	$24.00	$17.00
1g	97%	in stock	$34.00	$24.00
5g	97%	in stock	$98.00	$69.00
10g	97%	in stock	$148.00	$104.00
25g	97%	in stock	$210.00	$147.00

Description

• Catalog Number: AB48140
• Chemical Name: Boc-3,4-dichloro-l-phenylalanine
• CAS Number: 80741-39-5
• Molecular Formula: C14H17Cl2NO4
• Molecular Weight: 334.1951
• MDL Number: MFCD00273436
• SMILES: O=C(OC(C)(C)C)N[C@H](C(=O)O)Cc1ccc(c(c1)Cl)Cl

Computed Properties

• Complexity: 384
• Covalently-Bonded Unit Count: 1
• Defined Atom Stereocenter Count: 1
• Heavy Atom Count: 21
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 6
• XLogP3: 3.8

Literature

• Stereoselective preparation of N-[(R,R)-(E)-1-(3,4-dichlorobenzyl)-3- (2-oxoazepan-3-yl)carbamoyl]allyl-N-methyl-3,5-bis(trifluoromethyl)benzamide, a potent and orally active dual neurokinin NK(1)/NK(2) receptor antagonist.

  Journal of medicinal chemistry 20030731