25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether
TL;DR: 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether (CAS 133191-08-9) is a chemical compound with molecular formula C36H53N5O4 and molecular weight 619.41 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-[(5S)-5-[3-(4-azido-2-nitroanilino)propoxy]-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methylheptan-2-ol
Also Known As: 25-Ane, 25-Hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether, (6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-[(5S)-5-[3-(4-azido-2-nitroanilino)propoxy]-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methylheptan-2-ol, 9,10-Secocholesta-5,7,10(19)-trien-25-ol, 3-(3-((4-azido-2-nitrophyenyl)amino)propoxy)-, (3beta,5Z,7E)-, RefChem:89901
| Molecular Formula | C36H53N5O4 |
|---|---|
| Molecular Weight | 619.41 g/mol |
| LogP | 10.1104 |
| Topological Polar Surface Area | 133.39 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 14 |
| Exact Mass | 619.4097 |
| Heavy Atoms | 45 |
| Complexity | 1324.931 |
Chemical Identifiers
| CAS Number | 133191-08-9 |
|---|---|
| SMILES | C[C@H](CCCC(C)(C)O)[C@H]1CCC\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](CCC3=C)OCCCNC4=C(C=C(C=C4)N=[N+]=[N-])[N+](=O)[O-])C |
Product Overview
25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether (CAS 133191-08-9), with molecular formula C36H53N5O4 and molecular weight 619.41 g/mol. IUPAC: (6R)-6-[(1R,4E,7aR)-4-[(2Z)-2-[(5S)-5-[3-(4-azido-2-nitroanilino)propoxy]-2-methylidenecyclohexylidene]ethylidene]-7a-methyl-2,3,3a,5,6,7-hexahydro-1H-inden-1-yl]-2-methylheptan-2-ol.
Chemical Property Profile of 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether
Property Insights of 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether
The XLogP value of 10.1104 indicates that 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 133.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether. Following Lipinski's Rule of Five, 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether?
The CAS number of 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether is 133191-08-9.
What is the molecular formula of 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether?
The molecular formula of 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether is C36H53N5O4.
What is the molecular weight of 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether?
The molecular weight of 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether is 619.41 g/mol.
Where can I buy 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether?
You can request a quote for 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether?
Yes, KEHONG BIO provides custom synthesis services for 25-hydroxyvitamin D3 3'-(N-(4-azido-2-nitrophenyl)amino)propyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.