cep-2563 dihydrochloride
TL;DR: cep-2563 dihydrochloride (CAS 183488-70-2) is a chemical compound with molecular formula C36H42Cl2N6O6 and molecular weight 724.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(15S,16S,18R)-16-methoxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20,22,24,26-nonaen-16-yl]methyl 3-[[(2S)-2,6-diaminohexanoyl]amino]propanoate;dihydrochloride
Also Known As: cep-2563 dihydrochloride, CEP 2563, [(15S,16S,18R)-16-Methoxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20,22,24,26-nonaen-16-yl]methyl 3-[[(2S)-2,6-diaminohexanoyl]amino]propanoate;dihydrochloride, N-Lys-b-Ala-(9S-(9a,10b,12a))-(2,3,9,10,11,12-hexahydro-10-methoxy-9-methyl-1-oxo-9,12-epoxy-1H-diindolo(1,2,3-fg:3',2',1'-kl)pyrrolo(3,4-i)(1,6)benzodiazocin-10-yl)methyl ester dihydrochloride, .BETA.-ALANINE, N-L-LYSYL-, (2,3,9,10,11,12-HEXAHYDRO-10-METHOXY-9-METHYL-1-OXO-9,12-EPOXY-1H-DIINDOLO(1,2,3-FG:3',2',1'-KL)PYRROLO(3,4-I)(1,6)BENZODIAZOCIN-10-YL)METHYL ESTER, DIHYDROCHLORIDE, (9S-(9.ALPHA.,10.BETA.,12.ALPHA.))-
| Molecular Formula | C36H42Cl2N6O6 |
|---|---|
| Molecular Weight | 724.25 g/mol |
| LogP | 4.4856 |
| Topological Polar Surface Area | 164.86 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 724.2543 |
| Heavy Atoms | 50 |
| Complexity | 2165.3777 |
Chemical Identifiers
| CAS Number | 183488-70-2 |
|---|---|
| SMILES | C[C@@]12[C@](C[C@@H](O1)N3C4=CC=CC=C4C5=C6C(=C7C8=CC=CC=C8N2C7=C53)CNC6=O)(COC(=O)CCNC(=O)[C@H](CCCCN)N)OC.Cl.Cl |
Product Overview
cep-2563 dihydrochloride (CAS 183488-70-2), with molecular formula C36H42Cl2N6O6 and molecular weight 724.25 g/mol. IUPAC: [(15S,16S,18R)-16-methoxy-15-methyl-3-oxo-28-oxa-4,14,19-triazaoctacyclo[12.11.2.115,18.02,6.07,27.08,13.019,26.020,25]octacosa-1,6,8,10,12,20,22,24,26-nonaen-16-yl]methyl 3-[[(2S)-2,6-diaminohexanoyl]amino]propanoate;dihydrochloride.
Chemical Property Profile of cep-2563 dihydrochloride
Property Insights of cep-2563 dihydrochloride
The XLogP value of 4.4856 indicates that cep-2563 dihydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 164.86 Ų indicates high polarity, suggesting cep-2563 dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, cep-2563 dihydrochloride has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of cep-2563 dihydrochloride?
The CAS number of cep-2563 dihydrochloride is 183488-70-2.
What is the molecular formula of cep-2563 dihydrochloride?
The molecular formula of cep-2563 dihydrochloride is C36H42Cl2N6O6.
What is the molecular weight of cep-2563 dihydrochloride?
The molecular weight of cep-2563 dihydrochloride is 724.25 g/mol.
Where can I buy cep-2563 dihydrochloride?
You can request a quote for cep-2563 dihydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cep-2563 dihydrochloride?
Yes, KEHONG BIO provides custom synthesis services for cep-2563 dihydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.