C15H20BrClO
TL;DR: C15H20BrClO (CAS 83060-13-3) is a chemical compound with molecular formula C15H20BrClO and molecular weight 330.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3S,5Z,8S)-8-[(1S)-1-bromopropyl]-3-chloro-2-[(Z)-pent-2-en-4-ynyl]-3,4,7,8-tetrahydro-2H-oxocine
Also Known As: 6-Dimethylamino-2'-deoxyguanosine, J1.947.339B, 2H-Oxocin, 8-((1S)-1-bromopropyl)-3-chloro-3,4,7,8-tetrahydro-2-(2Z)-2-penten-4-ynyl-, (2S,3S,8S)-, (2S,3S,5Z,8S)-8-[(1S)-1-bromopropyl]-3-chloro-2-[(Z)-pent-2-en-4-ynyl]-3,4,7,8-tetrahydro-2H-oxocine, (2S,3S,8S)-8-[(1S)-1-bromopropyl]-3-chloro-2-[(2Z)-pent-2-en-4-yn-1-yl]-3,4,7,8-tetrahydro-2H-oxocine
| Molecular Formula | C15H20BrClO |
|---|---|
| Molecular Weight | 330.04 g/mol |
| LogP | 4.4506 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.0386 |
| Heavy Atoms | 18 |
| Complexity | 331.87552 |
Chemical Identifiers
| CAS Number | 83060-13-3 |
|---|---|
| SMILES | CC[C@@H]([C@@H]1C/C=C\C[C@@H]([C@@H](O1)C/C=C\C#C)Cl)Br |
Product Overview
C15H20BrClO (CAS 83060-13-3), with molecular formula C15H20BrClO and molecular weight 330.04 g/mol. IUPAC: (2S,3S,5Z,8S)-8-[(1S)-1-bromopropyl]-3-chloro-2-[(Z)-pent-2-en-4-ynyl]-3,4,7,8-tetrahydro-2H-oxocine.
Chemical Property Profile of C15H20BrClO
Property Insights of C15H20BrClO
The XLogP value of 4.4506 indicates that C15H20BrClO is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, C15H20BrClO exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, C15H20BrClO has 0 hydrogen bond donor(s) and 1 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 C15H20BrClO?
The CAS number of C15H20BrClO is 83060-13-3.
What is the molecular formula of C15H20BrClO?
The molecular formula of C15H20BrClO is C15H20BrClO.
What is the molecular weight of C15H20BrClO?
The molecular weight of C15H20BrClO is 330.04 g/mol.
Where can I buy C15H20BrClO?
You can request a quote for C15H20BrClO directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C15H20BrClO?
Yes, KEHONG BIO provides custom synthesis services for C15H20BrClO and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.