UPCMLD0ENAT5890908:001
TL;DR: UPCMLD0ENAT5890908:001 (CAS 379241-30-2) is a chemical compound with molecular formula C26H19N3O5S2 and molecular weight 517.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(furan-2-yl)-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide
Also Known As: UPCMLD0ENAT5890908:001, AF-399/40885976, F1174-1583, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(furan-2-yl)-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide, N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-{[5-(furan-2-yl)-4-oxo-3-phenyl-3H,4H-thieno[2,3-d]pyrimidin-2-yl]sulfanyl}acetamide
| Molecular Formula | C26H19N3O5S2 |
|---|---|
| Molecular Weight | 517.08 g/mol |
| LogP | 5.2092 |
| Topological Polar Surface Area | 95.59 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 517.0766 |
| Heavy Atoms | 36 |
| Complexity | 1610.4213 |
Chemical Identifiers
| CAS Number | 379241-30-2 |
|---|---|
| SMILES | C1COC2=C(O1)C=CC(=C2)NC(=O)CSC3=NC4=C(C(=CS4)C5=CC=CO5)C(=O)N3C6=CC=CC=C6 |
Product Overview
UPCMLD0ENAT5890908:001 (CAS 379241-30-2), with molecular formula C26H19N3O5S2 and molecular weight 517.08 g/mol. IUPAC: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-(furan-2-yl)-4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide.
Chemical Property Profile of UPCMLD0ENAT5890908:001
Property Insights of UPCMLD0ENAT5890908:001
The XLogP value of 5.2092 indicates that UPCMLD0ENAT5890908:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.59 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5890908:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5890908:001 has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of UPCMLD0ENAT5890908:001?
The CAS number of UPCMLD0ENAT5890908:001 is 379241-30-2.
What is the molecular formula of UPCMLD0ENAT5890908:001?
The molecular formula of UPCMLD0ENAT5890908:001 is C26H19N3O5S2.
What is the molecular weight of UPCMLD0ENAT5890908:001?
The molecular weight of UPCMLD0ENAT5890908:001 is 517.08 g/mol.
Where can I buy UPCMLD0ENAT5890908:001?
You can request a quote for UPCMLD0ENAT5890908:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5890908:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5890908:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.