Difluorostatone deriv.
TL;DR: Difluorostatone deriv. (CAS 148797-25-5) is a chemical compound with molecular formula C32H35F2N3O5 and molecular weight 579.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl N-[(2S)-1-[[(2S)-5-(benzylamino)-4,4-difluoro-3,5-dioxo-1-phenylpentan-2-yl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
Also Known As: Difluorostatone deriv., Carbamic acid, (1-(((3,3-difluoro-2,4-dioxo-1-(phenylmethyl)-4-((phenylmethyl)amino)butyl)amino)carbonyl)-3-methylbutyl)-, phenylmethyl ester, Benzyl [(2S)-1-{[(2S)-5-(benzylamino)-4,4-difluoro-3,5-dioxo-1-phenylpentan-2-yl]amino}-3,3-dimethyl-1-oxobutan-2-yl]carbamate, benzyl N-[(1S)-1-[[(1S)-1-benzyl-4-(benzylamino)-3,3-difluoro-2,4-dioxo-butyl]carbamoyl]-2,2-dimethyl-propyl]carbamate, benzyl N-[(2S)-1-[[(2S)-5-(benzylamino)-4,4-difluoro-3,5-dioxo-1-phenylpentan-2-yl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamate
| Molecular Formula | C32H35F2N3O5 |
|---|---|
| Molecular Weight | 579.25 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 579.25446 |
| Heavy Atoms | 42 |
| Complexity | 904.0 |
Chemical Identifiers
| CAS Number | 148797-25-5 |
|---|---|
| SMILES | CC(C)(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)C(C(=O)NCC2=CC=CC=C2)(F)F)NC(=O)OCC3=CC=CC=C3 |
| InChIKey | MHTORQLPWQIZJN-IZZNHLLZSA-N |
Product Overview
Difluorostatone deriv. (CAS 148797-25-5), with molecular formula C32H35F2N3O5 and molecular weight 579.25 g/mol. IUPAC: benzyl N-[(2S)-1-[[(2S)-5-(benzylamino)-4,4-difluoro-3,5-dioxo-1-phenylpentan-2-yl]amino]-3,3-dimethyl-1-oxobutan-2-yl]carbamate.
Chemical Property Profile of Difluorostatone deriv.
Property Insights of Difluorostatone deriv.
The XLogP value of 6.0 indicates that Difluorostatone deriv. is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Difluorostatone deriv.. Following Lipinski's Rule of Five, Difluorostatone deriv. has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Difluorostatone deriv.?
The CAS number of Difluorostatone deriv. is 148797-25-5.
What is the molecular formula of Difluorostatone deriv.?
The molecular formula of Difluorostatone deriv. is C32H35F2N3O5.
What is the molecular weight of Difluorostatone deriv.?
The molecular weight of Difluorostatone deriv. is 579.25 g/mol.
Where can I buy Difluorostatone deriv.?
You can request a quote for Difluorostatone deriv. directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Difluorostatone deriv.?
Yes, KEHONG BIO provides custom synthesis services for Difluorostatone deriv. and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.