Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- structure

Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-

TL;DR: Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- (CAS 91067-54-8) is a chemical compound with molecular formula C16H18N4O8S and molecular weight 426.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

N-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]-4-nitrobenzenesulfonamide

Also Known As: 5'-deoxy-5'-p-nitrobenzenesulphonylaminothymidine, Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-, 2,4(1H,3H)-Pyrimidinedione, 1-[2,5-dideoxy-5-[[(4-nitrophenyl)sulfonyl]amino]-b-D-erythro-pentofuranosyl]-5-methyl-, N-[(2R,3S,5R)-3-Hydroxy-5-(5-methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-tetrahydro-furan-2-ylmethyl]-4-nitro-benzenesulfonamide, N-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl]-4-nitro-benzenesulfonamide

CAS: 91067-54-8
Molecular Formula C16H18N4O8S
Molecular Weight 426.08 g/mol
LogP -0.61988
Topological Polar Surface Area 173.63 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 8
Rotatable Bonds 6
Exact Mass 426.08453
Heavy Atoms 29
Complexity 1138.7451

Chemical Identifiers

CAS Number 91067-54-8
SMILES CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CNS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-])O

Product Overview

Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- (CAS 91067-54-8), with molecular formula C16H18N4O8S and molecular weight 426.08 g/mol. IUPAC: N-[[(2R,3S,5R)-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl]-4-nitrobenzenesulfonamide.

🧪
Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →

Chemical Property Profile of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-

XLogP
-0.61988
TPSA (Topological Polar Surface Area)
173.63
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
8
Rotatable Bonds
6
Heavy Atoms
29
Complexity
1138.7451
Exact Mass
426.08453
Monoisotopic Mass
426.08453
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-

The XLogP value of -0.61988 indicates that Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 173.63 Ų indicates high polarity, suggesting Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?

The CAS number of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- is 91067-54-8.

What is the molecular formula of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?

The molecular formula of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- is C16H18N4O8S.

What is the molecular weight of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?

The molecular weight of Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- is 426.08 g/mol.

Where can I buy Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?

You can request a quote for Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]-?

Yes, KEHONG BIO provides custom synthesis services for Thymidine, 5'-deoxy-5'-[[(4-nitrophenyl)sulfonyl]amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

🤖 科弘生物 AI 助手 ×
您好!我是 科弘生物 AI 助手。可以问我产品搜索、询价、样品或技术问题。如何帮助您?