bradykinin, Leu-Ile-Ser-
TL;DR: bradykinin, Leu-Ile-Ser- (CAS 117525-89-0) is a chemical compound with molecular formula C65H100N18O15 and molecular weight 1372.76 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
Also Known As: Leu-T-kinin, Bradykinin, leu-ile-ser-, Leu-ile-ser-bradykinin, Bradykinin, leucyl-isoleucyl-serine-, (2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid
| Molecular Formula | C65H100N18O15 |
|---|---|
| Molecular Weight | 1372.76 g/mol |
| LogP | -4.4495 |
| Topological Polar Surface Area | 526.31 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 38 |
| Exact Mass | 1372.7616 |
| Heavy Atoms | 98 |
| Complexity | 3117.1318 |
Chemical Identifiers
| CAS Number | 117525-89-0 |
|---|---|
| SMILES | CC[C@H](C)[C@@H](C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)NCC(=O)N[C@@H](CC3=CC=CC=C3)C(=O)N[C@@H](CO)C(=O)N4CCC[C@H]4C(=O)N[C@@H](CC5=CC=CC=C5)C(=O)N[C@@H](CCCN=C(N)N)C(=O)O)NC(=O)[C@H](CC(C)C)N |
Product Overview
bradykinin, Leu-Ile-Ser- (CAS 117525-89-0), with molecular formula C65H100N18O15 and molecular weight 1372.76 g/mol. IUPAC: (2S)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[2-[[(2S)-1-[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S,3S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-methylpentanoyl]amino]-3-hydroxypropanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-3-hydroxypropanoyl]pyrrolidine-2-carbonyl]amino]-3-phenylpropanoyl]amino]-5-(diaminomethylideneamino)pentanoic acid.
Chemical Property Profile of bradykinin, Leu-Ile-Ser-
Property Insights of bradykinin, Leu-Ile-Ser-
The XLogP value of -4.4495 indicates that bradykinin, Leu-Ile-Ser- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 526.31 Ų indicates high polarity, suggesting bradykinin, Leu-Ile-Ser- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, bradykinin, Leu-Ile-Ser- has 16 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 bradykinin, Leu-Ile-Ser-?
The CAS number of bradykinin, Leu-Ile-Ser- is 117525-89-0.
What is the molecular formula of bradykinin, Leu-Ile-Ser-?
The molecular formula of bradykinin, Leu-Ile-Ser- is C65H100N18O15.
What is the molecular weight of bradykinin, Leu-Ile-Ser-?
The molecular weight of bradykinin, Leu-Ile-Ser- is 1372.76 g/mol.
Where can I buy bradykinin, Leu-Ile-Ser-?
You can request a quote for bradykinin, Leu-Ile-Ser- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for bradykinin, Leu-Ile-Ser-?
Yes, KEHONG BIO provides custom synthesis services for bradykinin, Leu-Ile-Ser- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.