![[Pro9] Substance P structure](/static/products/1044/104486-69-3.webp)
[Pro9] Substance P
TL;DR: [Pro9] Substance P (CAS 104486-69-3) is a chemical compound with molecular formula C66H102N18O13S and molecular weight 1386.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[1-[6-amino-2-[[1-[2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-N-[5-amino-1-[[1-[[1-[2-[[1-[(1-amino-4-methylsulfanyl-1-oxobutan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]pentanediamide
Also Known As: [Pro9] Substance P|[Pro9]-Substance P|Substance P, pro(9)-|(Pro(9))substance P|Substance P, proline(9)-|Arg-Pro-Lys-Pro-Gln-Gln-Phe-Phe-Pro-Leu-Met-NH2|2-[[1-[6-amino-2-[[1-[2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-N-[5-amino-1-[[1-[[1-[2-[[1-[(1-amino-4-methylsulfanyl-1-oxobutan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]pentanediamide
| Molecular Formula | C66H102N18O13S |
|---|---|
| Molecular Weight | 1386.76 g/mol |
| LogP | -2.8362 |
| Topological Polar Surface Area | 510.34 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 41 |
| Exact Mass | 1386.7594 |
| Heavy Atoms | 98 |
| Complexity | 3089.7354 |
Chemical Identifiers
| CAS Number | 104486-69-3 |
|---|---|
| SMILES | CC(C)CC(C(=O)NC(CCSC)C(=O)N)NC(=O)C1CCCN1C(=O)C(CC2=CC=CC=C2)NC(=O)C(CC3=CC=CC=C3)NC(=O)C(CCC(=O)N)NC(=O)C(CCC(=O)N)NC(=O)C4CCCN4C(=O)C(CCCCN)NC(=O)C5CCCN5C(=O)C(CCCN=C(N)N)N |
Product Overview
[Pro9] Substance P (CAS 104486-69-3), with molecular formula C66H102N18O13S and molecular weight 1386.76 g/mol. IUPAC: 2-[[1-[6-amino-2-[[1-[2-amino-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]amino]hexanoyl]pyrrolidine-2-carbonyl]amino]-N-[5-amino-1-[[1-[[1-[2-[[1-[(1-amino-4-methylsulfanyl-1-oxobutan-2-yl)amino]-4-methyl-1-oxopentan-2-yl]carbamoyl]pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1,5-dioxopentan-2-yl]pentanediamide.
Chemical Property Profile of [Pro9] Substance P
Property Insights of [Pro9] Substance P
The XLogP value of -2.8362 indicates that [Pro9] Substance P is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 510.34 Ų indicates high polarity, suggesting [Pro9] Substance P may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, [Pro9] Substance P has 14 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of [Pro9] Substance P?
The CAS number of [Pro9] Substance P is 104486-69-3.
What is the molecular formula of [Pro9] Substance P?
The molecular formula of [Pro9] Substance P is C66H102N18O13S.
What is the molecular weight of [Pro9] Substance P?
The molecular weight of [Pro9] Substance P is 1386.76 g/mol.
Where can I buy [Pro9] Substance P?
You can request a quote for [Pro9] Substance P directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [Pro9] Substance P?
Yes, KEHONG BIO provides custom synthesis services for [Pro9] Substance P and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.