1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene
TL;DR: 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene (CAS 75946-87-1) is a chemical compound with molecular formula C27H46O2 and molecular weight 402.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[(2Z)-2-[7a-methyl-1-(6-methylheptan-2-yl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cycloheptane-1,4-diol
Also Known As: 1,4-Ddhns, 1,4-Dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene, 6-[(2Z)-2-[7a-methyl-1-(6-methylheptan-2-yl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cycloheptane-1,4-diol, A-Homo-19-nor-9,10-secocholesta-5,7-diene-1,4-diol, (1alpha,4alpha,5Z,7E)-, RefChem:73273
| Molecular Formula | C27H46O2 |
|---|---|
| Molecular Weight | 402.35 g/mol |
| LogP | 6.8138 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 402.3498 |
| Heavy Atoms | 29 |
| Complexity | 575.3452 |
Chemical Identifiers
| CAS Number | 75946-87-1 |
|---|---|
| SMILES | CC(C)CCCC(C)C1CCC\2C1(CCC/C2=C/C=C3CC(CCC(C3)O)O)C |
Product Overview
1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene (CAS 75946-87-1), with molecular formula C27H46O2 and molecular weight 402.35 g/mol. IUPAC: 6-[(2Z)-2-[7a-methyl-1-(6-methylheptan-2-yl)-2,3,3a,5,6,7-hexahydro-1H-inden-4-ylidene]ethylidene]cycloheptane-1,4-diol.
Chemical Property Profile of 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene
Property Insights of 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene
The XLogP value of 6.8138 indicates that 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene?
The CAS number of 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene is 75946-87-1.
What is the molecular formula of 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene?
The molecular formula of 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene is C27H46O2.
What is the molecular weight of 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene?
The molecular weight of 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene is 402.35 g/mol.
Where can I buy 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene?
You can request a quote for 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene?
Yes, KEHONG BIO provides custom synthesis services for 1,4-dihydroxy-3-deoxy-A-homo-19-nor-9,10-secocholesta-4,7-diene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.