Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate
TL;DR: Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate (CAS 98072-26-5) is a chemical compound with molecular formula C24H37N5O4 and molecular weight 459.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-[1-(17-azido-3,16-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)ethylideneamino]carbamate
Also Known As: Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate, , CID9576633, Ethyl (17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate, 98072-26-5, EINECS 308-476-4, CID9576633, Ethyl (17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate, 98072-26-5
| Molecular Formula | C24H37N5O4 |
|---|---|
| Molecular Weight | 459.28 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 459.28455 |
| Heavy Atoms | 33 |
| Complexity | 915.0 |
Chemical Identifiers
| CAS Number | 98072-26-5 |
|---|---|
| SMILES | CCOC(=O)NN=C(C)C1(C(CC2C1(CCC3C2CC=C4C3(CCC(C4)O)C)C)O)N=[N+]=[N-] |
| InChIKey | STCBBMFHAJQVTA-UHFFFAOYSA-N |
Product Overview
Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate (CAS 98072-26-5), with molecular formula C24H37N5O4 and molecular weight 459.28 g/mol. IUPAC: ethyl N-[1-(17-azido-3,16-dihydroxy-10,13-dimethyl-1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-yl)ethylideneamino]carbamate.
Chemical Property Profile of Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate
Property Insights of Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate
The XLogP value of 4.2 indicates that Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate. Following Lipinski's Rule of Five, Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate?
The CAS number of Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate is 98072-26-5.
What is the molecular formula of Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate?
The molecular formula of Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate is C24H37N5O4.
What is the molecular weight of Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate?
The molecular weight of Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate is 459.28 g/mol.
Where can I buy Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate?
You can request a quote for Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl(17-azido-3beta,16alpha-dihydroxypregn-5-en-20-ylidene)carbazate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.