(S)-Bendroflumethiazide
TL;DR: (S)-Bendroflumethiazide (CAS 1245935-40-3) is a chemical compound with molecular formula C15H14F3N3O4S2 and molecular weight 421.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-benzyl-1,1-dioxo-6-(trifluoromethyl)-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide
Also Known As: (S)-Bendroflumethiazide, Bendrofluazide, Bendroflumethiazide, (S)-, CAS-73-48-3, (3S)-3-benzyl-1,1-dioxo-6-(trifluoromethyl)-3,4-dihydro-2H-1lambda6,2,4-benzothiadiazine-7-sulfonamide
| Molecular Formula | C15H14F3N3O4S2 |
|---|---|
| Molecular Weight | 421.04 g/mol |
| LogP | 1.6254 |
| Topological Polar Surface Area | 118.36 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 421.03778 |
| Heavy Atoms | 27 |
| Complexity | 1085.2805 |
Chemical Identifiers
| CAS Number | 1245935-40-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C[C@H]2NC3=C(C=C(C(=C3)C(F)(F)F)S(=O)(=O)N)S(=O)(=O)N2 |
Product Overview
(S)-Bendroflumethiazide (CAS 1245935-40-3), with molecular formula C15H14F3N3O4S2 and molecular weight 421.04 g/mol. IUPAC: (3S)-3-benzyl-1,1-dioxo-6-(trifluoromethyl)-3,4-dihydro-2H-1λ6,2,4-benzothiadiazine-7-sulfonamide.
Chemical Property Profile of (S)-Bendroflumethiazide
Property Insights of (S)-Bendroflumethiazide
The XLogP value of 1.6254 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-Bendroflumethiazide. The TPSA of 118.36 Ų falls within the moderate polarity range, balancing permeability and solubility for (S)-Bendroflumethiazide. Following Lipinski's Rule of Five, (S)-Bendroflumethiazide has 3 hydrogen bond donor(s) and 5 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 (S)-Bendroflumethiazide?
The CAS number of (S)-Bendroflumethiazide is 1245935-40-3.
What is the molecular formula of (S)-Bendroflumethiazide?
The molecular formula of (S)-Bendroflumethiazide is C15H14F3N3O4S2.
What is the molecular weight of (S)-Bendroflumethiazide?
The molecular weight of (S)-Bendroflumethiazide is 421.04 g/mol.
Where can I buy (S)-Bendroflumethiazide?
You can request a quote for (S)-Bendroflumethiazide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (S)-Bendroflumethiazide?
Yes, KEHONG BIO provides custom synthesis services for (S)-Bendroflumethiazide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.