UPCMLD0ENAT5797464:001
TL;DR: UPCMLD0ENAT5797464:001 (CAS 830340-66-4) is a chemical compound with molecular formula C15H13NO5S and molecular weight 319.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)thiophene-2-carboxylate
Also Known As: UPCMLD0ENAT5797464:001, methyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)thiophene-2-carboxylate, methyl 3-(2,3-dihydrobenzo[b][1,4]dioxine-6-carboxamido)thiophene-2-carboxylate, methyl 3-(2H,3H-benzo[3,4-e]1,4-dioxan-6-ylcarbonylamino)thiophene-2-carboxyla te, METHYL 3-[(2,3-DIHYDRO-1,4-BENZODIOXIN-6-YLCARBONYL)AMINO]-2-THIOPHENECARBOXYLATE
| Molecular Formula | C15H13NO5S |
|---|---|
| Molecular Weight | 319.05 g/mol |
| LogP | 2.5582 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 319.05145 |
| Heavy Atoms | 22 |
| Complexity | 724.4729 |
Chemical Identifiers
| CAS Number | 830340-66-4 |
|---|---|
| SMILES | COC(=O)C1=C(C=CS1)NC(=O)C2=CC3=C(C=C2)OCCO3 |
Product Overview
UPCMLD0ENAT5797464:001 (CAS 830340-66-4), with molecular formula C15H13NO5S and molecular weight 319.05 g/mol. IUPAC: methyl 3-(2,3-dihydro-1,4-benzodioxine-6-carbonylamino)thiophene-2-carboxylate.
Chemical Property Profile of UPCMLD0ENAT5797464:001
Property Insights of UPCMLD0ENAT5797464:001
The XLogP value of 2.5582 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT5797464:001. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5797464:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5797464:001 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 UPCMLD0ENAT5797464:001?
The CAS number of UPCMLD0ENAT5797464:001 is 830340-66-4.
What is the molecular formula of UPCMLD0ENAT5797464:001?
The molecular formula of UPCMLD0ENAT5797464:001 is C15H13NO5S.
What is the molecular weight of UPCMLD0ENAT5797464:001?
The molecular weight of UPCMLD0ENAT5797464:001 is 319.05 g/mol.
Where can I buy UPCMLD0ENAT5797464:001?
You can request a quote for UPCMLD0ENAT5797464:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5797464:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5797464:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.