Npc 16731
TL;DR: Npc 16731 (CAS 130308-39-3) is a chemical compound with molecular formula C60H85N19O13S and molecular weight 1311.6295 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,4R)-N-[2-[[(2S,3R)-1-[(2S)-1-[(2S)-2-[[(2R)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidin-2-yl]-5-(diaminomethylideneamino)-2-(dihydroxymethyl)-3-[hydroxy(isoquinolin-1-yl)methyl]-1-oxo-3-(1,2,3,4-tetrahydroisoquinoline-1-carbonyl)pentan-2-yl]-[(2S)-2-[[(2S)-2-amino-3-thiophen-2-ylpropanoyl]amino]-3-hydroxypropanoyl]amino]-2-oxoethyl]-4-hydroxypyrrolidine-2-carboxamide
Also Known As: Npc 16731, Arg(hyp(3)-thi(5)-tic(7)-tic(8))-bradykinin, Bradykinin, arg(hyp(3)-thi(5)-tic(7)-tic(8))-, (2S,4R)-N-[2-[[(2S,3R)-1-[(2S)-1-[(2S)-2-[[(2R)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]pyrrolidin-2-yl]-5-(diaminomethylideneamino)-2-(dihydroxymethyl)-3-[hydroxy(isoquinolin-1-yl)methyl]-1-oxo-3-(1,2,3,4-tetrahydroisoquinoline-1-carbonyl)pentan-2-yl]-[(2S)-2-[[(2S)-2-amino-3-thiophen-2-ylpropanoyl]amino]-3-hydroxypropanoyl]amino]-2-oxoethyl]-4-hydroxypyrrolidine-2-carboxamide, L-Arginine, D-arginyl-L-arginyl-L-prolyl-trans-4-hydroxy-L-prolylglycyl-3-(2-thienyl)-L-alanyl-L-seryl-D-1,2,3,4-tetrahydro-3-isoquinolinecarbonyl-L-1,2,3,4-tetrahydro-3-isoquinolinecarbonyl-
Technical Specifications
| Molecular Formula | C60H85N19O13S |
| Molecular Weight | 1311.6295 g/mol |
| XLogP | -6.5 |
| Topological Polar Surface Area (TPSA) | 591.0 Ų |
| Hydrogen Bond Donors | 18 |
| Hydrogen Bond Acceptors | 22 |
| Rotatable Bonds | 32 |
| Exact Mass | 1311.6295 Da |
| Heavy Atoms | 93 |
| Complexity | 2690.0 |
| SMILES | C1C[C@H](N(C1)C(=O)[C@H](CCCN=C(N)N)NC(=O)[C@@H](CCCN=C(N)N)N)C(=O)[C@@](C(O)O)([C@](CCN=C(N)N)(C(C2=NC=CC3=CC=CC=C32)O)C(=O)C4C5=CC=CC=C5CCN4)N(C(=O)CNC(=O)[C@@H]6C[C@H](CN6)O)C(=O)[C@H](CO)NC(=O)[C@H](CC7=CC=CS7)N |
| InChIKey | FNVLUJJICGWTDS-UUNFCWPASA-N |
Chemical Property Profile of Npc 16731
Property Insights of Npc 16731
The XLogP value of -6.5 indicates that Npc 16731 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 591.0 Ų indicates high polarity, suggesting Npc 16731 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Npc 16731 has 18 hydrogen bond donor(s) and 22 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Npc 16731?
The CAS number of Npc 16731 is 130308-39-3.
What is the molecular formula of Npc 16731?
The molecular formula of Npc 16731 is C60H85N19O13S.
What is the molecular weight of Npc 16731?
The molecular weight of Npc 16731 is 1311.6295 g/mol.
Where can I buy Npc 16731?
You can request a quote for Npc 16731 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Npc 16731?
Yes, CoreyChem provides custom synthesis services for Npc 16731 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.