Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2
TL;DR: Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 (CAS 77727-10-7) is a chemical compound with molecular formula C46H71N11O11S and molecular weight 985.5055 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[1-[(2-amino-2-oxoethyl)amino]-4-methyl-1-oxopentan-2-yl]-1-[7-(2-amino-2-oxoethyl)-10-(3-amino-3-oxopropyl)-13-butan-2-yl-16-[(4-ethylphenyl)methyl]-6,9,12,15,18-pentaoxo-1-thia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]pyrrolidine-2-carboxamide
Also Known As: Nacartocin, Nacartocina, Nacartocine, Nacartocinum, Nacartocin [INN]
Technical Specifications
| Molecular Formula | C46H71N11O11S |
| Molecular Weight | 985.5055 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 379.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 18 |
| Exact Mass | 985.5055 Da |
| Heavy Atoms | 69 |
| Complexity | 1850.0 |
| SMILES | CCC1=CC=C(C=C1)CC2C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(CCSCCC(=O)N2)C(=O)N3CCCC3C(=O)NC(CC(C)C)C(=O)NCC(=O)N)CC(=O)N)CCC(=O)N)C(C)CC |
| InChIKey | JPYLEKXLHLKVBI-UHFFFAOYSA-N |
Chemical Property Profile of Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2
Property Insights of Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2
The XLogP value of -0.3 indicates that Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 379.0 Ų indicates high polarity, suggesting Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 has 10 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2?
The CAS number of Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 is 77727-10-7.
What is the molecular formula of Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2?
The molecular formula of Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 is C46H71N11O11S.
What is the molecular weight of Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2?
The molecular weight of Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 is 985.5055 g/mol.
Where can I buy Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2?
You can request a quote for Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2?
Yes, CoreyChem provides custom synthesis services for Ac(1)-DL-Phe(4-Et)-DL-xiIle-DL-Gln-DL-Asn-DL-Met(1)-DL-Pro-DL-Leu-Gly-NH2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.