UK 88947
TL;DR: UK 88947 (CAS 137015-76-0) is a chemical compound with molecular formula C41H62ClN5O7 and molecular weight 771.43 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-amino-4-[[(2S,5R,8S)-8-[(1-aminocyclohexanecarbonyl)amino]-3-hydroxy-5-(3-methylbutylcarbamoyl)-7-oxo-1,9-diphenyl-6-propan-2-ylnonan-2-yl]amino]-4-oxobutanoic acid;hydrochloride
Also Known As: UK 88947, (3S)-3-amino-4-[[(2S,5R,8S)-8-[(1-aminocyclohexanecarbonyl)amino]-3-hydroxy-5-(3-methylbutylcarbamoyl)-7-oxo-1,9-diphenyl-6-propan-2-ylnonan-2-yl]amino]-4-oxobutanoic acid;hydrochloride, N-Isopentyl-5-(1-aminocyclohexylcarbonyl-phenylalanyl-asparaginylamino)-4-hydroxy-2-isobutyl-6-phenylhexanamide, L-Aspartamide, N-((1-aminocyclohexyl)carbonyl)-L-phenylalanyl-N1-(2-hydroxy-6-methyl-4-(((2-methylpropyl)amino)carbonyl)-1-(phenylmethyl)heptyl)-, monohydrochloride, (1S-(1R*,2R*,4S*))-, N-Isopentyl 5-(1-aminocyclohexylcarbonyl-phe-asn-amino)-4-hydroxy-2-isobutyl-6-phenylhexanamide
| Molecular Formula | C41H62ClN5O7 |
|---|---|
| Molecular Weight | 771.43 g/mol |
| LogP | 3.6976 |
| Topological Polar Surface Area | 213.94 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 21 |
| Exact Mass | 771.4338 |
| Heavy Atoms | 54 |
| Complexity | 1487.2137 |
Chemical Identifiers
| CAS Number | 137015-76-0 |
|---|---|
| SMILES | CC(C)CCNC(=O)[C@H](CC([C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(=O)O)N)O)C(C(C)C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)C3(CCCCC3)N.Cl |
Product Overview
UK 88947 (CAS 137015-76-0), with molecular formula C41H62ClN5O7 and molecular weight 771.43 g/mol. IUPAC: (3S)-3-amino-4-[[(2S,5R,8S)-8-[(1-aminocyclohexanecarbonyl)amino]-3-hydroxy-5-(3-methylbutylcarbamoyl)-7-oxo-1,9-diphenyl-6-propan-2-ylnonan-2-yl]amino]-4-oxobutanoic acid;hydrochloride.
Chemical Property Profile of UK 88947
Property Insights of UK 88947
The XLogP value of 3.6976 indicates that UK 88947 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 213.94 Ų indicates high polarity, suggesting UK 88947 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, UK 88947 has 7 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UK 88947?
The CAS number of UK 88947 is 137015-76-0.
What is the molecular formula of UK 88947?
The molecular formula of UK 88947 is C41H62ClN5O7.
What is the molecular weight of UK 88947?
The molecular weight of UK 88947 is 771.43 g/mol.
Where can I buy UK 88947?
You can request a quote for UK 88947 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UK 88947?
Yes, KEHONG BIO provides custom synthesis services for UK 88947 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.