Btm 1073
TL;DR: Btm 1073 (CAS 107784-01-0) is a chemical compound with molecular formula C25H34BrN3OS and molecular weight 503.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R)-3-[(4-butyl-4-methylpiperazin-4-ium-1-yl)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one bromide
Also Known As: Btm 1073, Piperazinium, 1-butyl-1-methyl-4-((2,3,4,5-tetrahydro-4-oxo-2-phenyl-1,5-benzothiazepin-3-yl)methyl)-, bromide, cis-, 2,3-Dihydro-3-(4-methylpiperazinylbutyl bromide)-2-phenyl-1,5-benzothiazepin-4(5H)-one, (2S,3R)-3-[(4-Butyl-4-methylpiperazin-4-ium-1-yl)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one;bromide, (2S,3R)-3-[(4-butyl-4-methylpiperazin-4-ium-1-yl)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one bromide
| Molecular Formula | C25H34BrN3OS |
|---|---|
| Molecular Weight | 503.16 g/mol |
| LogP | 1.6546 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 503.1606 |
| Heavy Atoms | 31 |
| Complexity | 557.0 |
Chemical Identifiers
| CAS Number | 107784-01-0 |
|---|---|
| SMILES | CCCC[N+]1(CCN(CC1)C[C@H]2[C@H](SC3=CC=CC=C3NC2=O)C4=CC=CC=C4)C.[Br-] |
| InChIKey | ULKPDEMITLLZHJ-NXCGSPNESA-N |
Product Overview
Btm 1073 (CAS 107784-01-0), with molecular formula C25H34BrN3OS and molecular weight 503.16 g/mol. IUPAC: (2S,3R)-3-[(4-butyl-4-methylpiperazin-4-ium-1-yl)methyl]-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one bromide.
Chemical Property Profile of Btm 1073
Property Insights of Btm 1073
The XLogP value of 1.6546 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Btm 1073. With a topological polar surface area (TPSA) of 57.6 Ų, Btm 1073 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Btm 1073 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Btm 1073?
The CAS number of Btm 1073 is 107784-01-0.
What is the molecular formula of Btm 1073?
The molecular formula of Btm 1073 is C25H34BrN3OS.
What is the molecular weight of Btm 1073?
The molecular weight of Btm 1073 is 503.16 g/mol.
Where can I buy Btm 1073?
You can request a quote for Btm 1073 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Btm 1073?
Yes, KEHONG BIO provides custom synthesis services for Btm 1073 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.