SB 204070 hydrochloride
TL;DR: SB 204070 hydrochloride (CAS 148702-58-3) is a chemical compound with molecular formula C19H27ClN2O4 and molecular weight 382.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-butylpiperidin-4-yl)methyl 5-amino-6-chloro-2,3-dihydro-1,4-benzodioxine-8-carboxylate
Also Known As: SB 204070 hydrochloride, 5-HT4 antagonist 3, nchembio873-comp53, SB-204070 hydrochloride, Lopac-S-3313
| Molecular Formula | C19H27ClN2O4 |
|---|---|
| Molecular Weight | 382.17 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 74.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 382.16592 |
| Heavy Atoms | 26 |
| Complexity | 459.0 |
Chemical Identifiers
| CAS Number | 148702-58-3 |
|---|---|
| SMILES | CCCCN1CCC(CC1)COC(=O)C2=CC(=C(C3=C2OCCO3)N)Cl |
| InChIKey | AOOSJYIINXVNHV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
SB 204070 hydrochloride (CAS 148702-58-3), with molecular formula C19H27ClN2O4 and molecular weight 382.17 g/mol. IUPAC: (1-butylpiperidin-4-yl)methyl 5-amino-6-chloro-2,3-dihydro-1,4-benzodioxine-8-carboxylate.
Chemical Property Profile of SB 204070 hydrochloride
Property Insights of SB 204070 hydrochloride
The XLogP value of 3.5 indicates that SB 204070 hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for SB 204070 hydrochloride. Following Lipinski's Rule of Five, SB 204070 hydrochloride has 1 hydrogen bond donor(s) and 6 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 SB 204070 hydrochloride?
The CAS number of SB 204070 hydrochloride is 148702-58-3.
What is the molecular formula of SB 204070 hydrochloride?
The molecular formula of SB 204070 hydrochloride is C19H27ClN2O4.
What is the molecular weight of SB 204070 hydrochloride?
The molecular weight of SB 204070 hydrochloride is 382.17 g/mol.
Where can I buy SB 204070 hydrochloride?
You can request a quote for SB 204070 hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SB 204070 hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for SB 204070 hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.