UPCMLD0ENAT0500-8412:001
TL;DR: UPCMLD0ENAT0500-8412:001 (CAS 301537-86-0) is a chemical compound with molecular formula C15H13Br2N3O3 and molecular weight 440.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(8,9-dibromo-3,5-dioxo-4-azatricyclo[5.2.1.02,6]decan-4-yl)pyridine-4-carboxamide
Also Known As: UPCMLD0ENAT0500-8412:001, AB00685269-01, F0827-0138, N-(5,6-dibromo-1,3-dioxohexahydro-1H-4,7-methanoisoindol-2(3H)-yl)isonicotinamide, N-{8,9-dibromo-3,5-dioxo-4-azatricyclo[5.2.1.0^{2,6}]decan-4-yl}pyridine-4-carboxamide
| Molecular Formula | C15H13Br2N3O3 |
|---|---|
| Molecular Weight | 440.93 g/mol |
| LogP | 1.5043 |
| Topological Polar Surface Area | 79.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 440.93237 |
| Heavy Atoms | 23 |
| Complexity | 666.46735 |
Chemical Identifiers
| CAS Number | 301537-86-0 |
|---|---|
| SMILES | C1C2C3C(C1C(C2Br)Br)C(=O)N(C3=O)NC(=O)C4=CC=NC=C4 |
Product Overview
UPCMLD0ENAT0500-8412:001 (CAS 301537-86-0), with molecular formula C15H13Br2N3O3 and molecular weight 440.93 g/mol. IUPAC: N-(8,9-dibromo-3,5-dioxo-4-azatricyclo[5.2.1.02,6]decan-4-yl)pyridine-4-carboxamide.
Chemical Property Profile of UPCMLD0ENAT0500-8412:001
Property Insights of UPCMLD0ENAT0500-8412:001
The XLogP value of 1.5043 suggests moderate lipophilicity, balancing water solubility and membrane permeability for UPCMLD0ENAT0500-8412:001. The TPSA of 79.37 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT0500-8412:001. Following Lipinski's Rule of Five, UPCMLD0ENAT0500-8412:001 has 1 hydrogen bond donor(s) and 4 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 UPCMLD0ENAT0500-8412:001?
The CAS number of UPCMLD0ENAT0500-8412:001 is 301537-86-0.
What is the molecular formula of UPCMLD0ENAT0500-8412:001?
The molecular formula of UPCMLD0ENAT0500-8412:001 is C15H13Br2N3O3.
What is the molecular weight of UPCMLD0ENAT0500-8412:001?
The molecular weight of UPCMLD0ENAT0500-8412:001 is 440.93 g/mol.
Where can I buy UPCMLD0ENAT0500-8412:001?
You can request a quote for UPCMLD0ENAT0500-8412:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0500-8412:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0500-8412:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.