Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide
TL;DR: Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide (CAS 95676-71-4) is a chemical compound with molecular formula C54H60N10O10S2 and molecular weight 1072.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,20-bis(acridin-9-ylamino)-4,17-dimethyl-11,24-di(propan-2-yl)-9,22-dioxa-28,29-dithia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontane-3,6,10,13,16,19,23,26-octone
Also Known As: Basacv, Bis((9-acridinyl)ser-ala-cys-val)dilactone disulfide, 7,20-bis(acridin-9-ylamino)-4,17-dimethyl-11,24-di(propan-2-yl)-9,22-dioxa-28,29-dithia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontane-3,6,10,13,16,19,23,26-octone, Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide, L-Valine, N-9-acridinyl-D-seryl-L-alanyl-L-cysteinyl-, (2S-(2alpha(R*),5alpha,6beta(1R*,2R*,3R*,4R*,5R*,6S*,9E,11S*,12S*,13E,15S*)))-
| Molecular Formula | C54H60N10O10S2 |
|---|---|
| Molecular Weight | 1072.39 g/mol |
| LogP | 6.6 |
| Topological Polar Surface Area | 328.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 6 |
| Exact Mass | 1072.3936 |
| Heavy Atoms | 76 |
| Complexity | 1900.0 |
Chemical Identifiers
| CAS Number | 95676-71-4 |
|---|---|
| SMILES | CC1C(=O)NC2CSSCC(C(=O)NC(C(=O)OCC(C(=O)N1)NC3=C4C=CC=CC4=NC5=CC=CC=C53)C(C)C)NC(=O)C(NC(=O)C(COC(=O)C(NC2=O)C(C)C)NC6=C7C=CC=CC7=NC8=CC=CC=C86)C |
| InChIKey | ULWPHLPBZICZKK-UHFFFAOYSA-N |
Product Overview
Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide (CAS 95676-71-4), with molecular formula C54H60N10O10S2 and molecular weight 1072.39 g/mol. IUPAC: 7,20-bis(acridin-9-ylamino)-4,17-dimethyl-11,24-di(propan-2-yl)-9,22-dioxa-28,29-dithia-2,5,12,15,18,25-hexazabicyclo[12.12.4]triacontane-3,6,10,13,16,19,23,26-octone.
Chemical Property Profile of Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide
Property Insights of Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide
The XLogP value of 6.6 indicates that Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 328.0 Ų indicates high polarity, suggesting Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide has 8 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide?
The CAS number of Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide is 95676-71-4.
What is the molecular formula of Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide?
The molecular formula of Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide is C54H60N10O10S2.
What is the molecular weight of Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide?
The molecular weight of Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide is 1072.39 g/mol.
Where can I buy Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide?
You can request a quote for Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide?
Yes, KEHONG BIO provides custom synthesis services for Bis((9-acridinyl)seryl-alanyl-cysteinyl-valine)dilactone disulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.