布林佐胺相关化合物B
TL;DR: 布林佐胺相关化合物B (CAS 220402-83-5) is a chemical compound with molecular formula C14H17N3O5S3 and molecular weight 403.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
布林佐胺相关化合物B
2-(3-methoxyphenyl)-4-(methylamino)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide
Also Known As: Brinzolamide Related Compound B, AL7099A, 2-(3-Methoxyphenyl)-4-(methylamino)-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~-thieno[3,2-e][1,2]thiazine-6-sulfonamide, 2-(3-methoxyphenyl)-4-(methylamino)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide, 2-(3-methoxyphenyl)-4-(methylamino)-3,4-dihydro-2H-thieno[3,2-e][1,2]thiazine-6-sulfonamide 1,1-dioxide
| Molecular Formula | C14H17N3O5S3 |
|---|---|
| Molecular Weight | 403.03 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 164.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 403.03302 |
| Heavy Atoms | 25 |
| Complexity | 687.0 |
Chemical Identifiers
| CAS Number | 220402-83-5 |
|---|---|
| SMILES | CNC1CN(S(=O)(=O)C2=C1C=C(S2)S(=O)(=O)N)C3=CC(=CC=C3)OC |
| InChIKey | RMOXCYSVWCHXII-UHFFFAOYSA-N |
Product Overview
布林佐胺相关化合物B (CAS 220402-83-5), with molecular formula C14H17N3O5S3 and molecular weight 403.03 g/mol. IUPAC: 2-(3-methoxyphenyl)-4-(methylamino)-1,1-dioxo-3,4-dihydrothieno[3,2-e]thiazine-6-sulfonamide.
Chemical Property Profile of 布林佐胺相关化合物B
Property Insights of 布林佐胺相关化合物B
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 布林佐胺相关化合物B. The TPSA of 164.0 Ų indicates high polarity, suggesting 布林佐胺相关化合物B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 布林佐胺相关化合物B has 2 hydrogen bond donor(s) and 9 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 布林佐胺相关化合物B?
The CAS number of 布林佐胺相关化合物B is 220402-83-5.
What is the molecular formula of 布林佐胺相关化合物B?
The molecular formula of 布林佐胺相关化合物B is C14H17N3O5S3.
What is the molecular weight of 布林佐胺相关化合物B?
The molecular weight of 布林佐胺相关化合物B is 403.03 g/mol.
Where can I buy 布林佐胺相关化合物B?
You can request a quote for 布林佐胺相关化合物B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 布林佐胺相关化合物B?
Yes, KEHONG BIO provides custom synthesis services for 布林佐胺相关化合物B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.