海牙替宁甲基氯化物
TL;DR: 海牙替宁甲基氯化物 (CAS 29900-15-0) is a chemical compound with molecular formula C39H46Cl2N2O6 and molecular weight 708.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
海牙替宁甲基氯化物
(1S,16S)-10,21,25-trimethoxy-15,15,30,30-tetramethyl-7,23-dioxa-15,30-diazoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaen-9-ol dichloride
Also Known As: Hayatinin methochloride, N,N'-Dimethylhayatininium dichloride, Hayatininium, N,N'-dimethyl-, dichloride, Tubocuraranium, 7'-hydroxy-6,6',12'-trimethoxy-2,2,2',2'-tetramethyl-, dichloride, (1'-alpha)-, (1S,16S)-10,21,25-trimethoxy-15,15,30,30-tetramethyl-7,23-dioxa-15,30-diazoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaen-9-ol;dichloride
| Molecular Formula | C39H46Cl2N2O6 |
|---|---|
| Molecular Weight | 708.27 g/mol |
| LogP | 1.1566 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 708.2733 |
| Heavy Atoms | 49 |
| Complexity | 1050.0 |
Chemical Identifiers
| CAS Number | 29900-15-0 |
|---|---|
| SMILES | C[N+]1(CCC2=CC(=C3C=C2[C@@H]1CC4=CC=C(C=C4)OC5=C6[C@H](CC7=CC(=C(C=C7)OC)O3)[N+](CCC6=CC(=C5O)OC)(C)C)OC)C.[Cl-].[Cl-] |
| InChIKey | DMCGWNPMCTWAOP-YBZGWEFGSA-M |
Product Overview
海牙替宁甲基氯化物 (CAS 29900-15-0), with molecular formula C39H46Cl2N2O6 and molecular weight 708.27 g/mol. IUPAC: (1S,16S)-10,21,25-trimethoxy-15,15,30,30-tetramethyl-7,23-dioxa-15,30-diazoniaheptacyclo[22.6.2.23,6.18,12.118,22.027,31.016,34]hexatriaconta-3(36),4,6(35),8(34),9,11,18(33),19,21,24,26,31-dodecaen-9-ol dichloride.
Chemical Property Profile of 海牙替宁甲基氯化物
Property Insights of 海牙替宁甲基氯化物
The XLogP value of 1.1566 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 海牙替宁甲基氯化物. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 海牙替宁甲基氯化物. Following Lipinski's Rule of Five, 海牙替宁甲基氯化物 has 1 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 海牙替宁甲基氯化物?
The CAS number of 海牙替宁甲基氯化物 is 29900-15-0.
What is the molecular formula of 海牙替宁甲基氯化物?
The molecular formula of 海牙替宁甲基氯化物 is C39H46Cl2N2O6.
What is the molecular weight of 海牙替宁甲基氯化物?
The molecular weight of 海牙替宁甲基氯化物 is 708.27 g/mol.
Where can I buy 海牙替宁甲基氯化物?
You can request a quote for 海牙替宁甲基氯化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 海牙替宁甲基氯化物?
Yes, KEHONG BIO provides custom synthesis services for 海牙替宁甲基氯化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.