Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine
TL;DR: Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine (CAS 1772-57-2) is a chemical compound with molecular formula C27H41N7O6 and molecular weight 559.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl-[(2R)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Also Known As: Ser-phe-oic-arg, KST-1A2067, Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine, (2S)-2-[2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl-[(2R)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid, (2s)-2-{[(2r)-2-{[(2s)-2-amino-3-hydroxypropanoyl]amino}-3-phenylpropanoyl](octahydro-1h-indol-2-ylcarbonyl)amino}-5-[(diaminomethylidene)amino]pentanoic acid(non-preferred name)
| Molecular Formula | C27H41N7O6 |
|---|---|
| Molecular Weight | 559.31 g/mol |
| LogP | -2.7 |
| Topological Polar Surface Area | 226.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 13 |
| Exact Mass | 559.3118 |
| Heavy Atoms | 40 |
| Complexity | 921.0 |
Chemical Identifiers
| CAS Number | 1772-57-2 |
|---|---|
| SMILES | C1CCC2C(C1)CC(N2)C(=O)N([C@@H](CCCN=C(N)N)C(=O)O)C(=O)[C@@H](CC3=CC=CC=C3)NC(=O)[C@H](CO)N |
| InChIKey | QRTGMFJIAAHXDZ-HICBPSBKSA-N |
Product Overview
Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine (CAS 1772-57-2), with molecular formula C27H41N7O6 and molecular weight 559.31 g/mol. IUPAC: (2S)-2-[2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carbonyl-[(2R)-2-[[(2S)-2-amino-3-hydroxypropanoyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid.
Chemical Property Profile of Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine
Property Insights of Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine
The XLogP value of -2.7 indicates that Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 226.0 Ų indicates high polarity, suggesting Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine?
The CAS number of Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine is 1772-57-2.
What is the molecular formula of Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine?
The molecular formula of Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine is C27H41N7O6.
What is the molecular weight of Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine?
The molecular weight of Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine is 559.31 g/mol.
Where can I buy Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine?
You can request a quote for Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine?
Yes, KEHONG BIO provides custom synthesis services for Seryl-phenylalanyl-octahydroindole-2-carbonyl-arginine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.