Substance P (4-11)
TL;DR: Substance P (4-11) (CAS 53749-60-3) is a chemical compound with molecular formula C46H67N11O10S and molecular weight 965.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-N-[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]-2-(pyrrolidine-2-carbonylamino)pentanediamide
Also Known As: Substance P octapeptide, Substance P (4-11), SP(4-11), 1-Dearginyl-2-deprolyl-3-delysine-substance P, Pro-Gln-Gln-Phe-Phe-Gly-Leu-Met-NH2
| Molecular Formula | C46H67N11O10S |
|---|---|
| Molecular Weight | 965.48 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 370.0 Ų |
| Hydrogen Bond Donors | 11 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 30 |
| Exact Mass | 965.4793 |
| Heavy Atoms | 68 |
| Complexity | 1730.0 |
Chemical Identifiers
| CAS Number | 53749-60-3 |
|---|---|
| SMILES | CC(C)CC(C(=O)N[C@@H](CCSC)C(=O)N)NC(=O)CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](CCC(=O)N)NC(=O)C3CCCN3 |
| InChIKey | XVTHVTVZLLFSPI-YJPQGOKNSA-N |
Product Overview
Substance P (4-11) (CAS 53749-60-3), with molecular formula C46H67N11O10S and molecular weight 965.48 g/mol. IUPAC: (2S)-N-[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]-2-(pyrrolidine-2-carbonylamino)pentanediamide.
Chemical Property Profile of Substance P (4-11)
Property Insights of Substance P (4-11)
The XLogP value of -0.1 indicates that Substance P (4-11) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 370.0 Ų indicates high polarity, suggesting Substance P (4-11) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Substance P (4-11) has 11 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Substance P (4-11)?
The CAS number of Substance P (4-11) is 53749-60-3.
What is the molecular formula of Substance P (4-11)?
The molecular formula of Substance P (4-11) is C46H67N11O10S.
What is the molecular weight of Substance P (4-11)?
The molecular weight of Substance P (4-11) is 965.48 g/mol.
Where can I buy Substance P (4-11)?
You can request a quote for Substance P (4-11) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Substance P (4-11)?
Yes, KEHONG BIO provides custom synthesis services for Substance P (4-11) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.