UPCMLD0ENAT5609870:001
TL;DR: UPCMLD0ENAT5609870:001 (CAS 313506-10-4) is a chemical compound with molecular formula C28H30N2O6 and molecular weight 490.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[3-[(3-methoxycarbonylphenyl)carbamoyl]adamantane-1-carbonyl]amino]benzoate
Also Known As: UPCMLD0ENAT5609870:001, BIM-0001514.P001, AB01326580-02, methyl 3-[(3-{N-[3-(methoxycarbonyl)phenyl]carbamoyl}adamantanyl)carbonylamino]benzoate, dimethyl 3,3'-(((1s,3s,5r,7r)-adamantane-1,3-dicarbonyl)bis(azanediyl))dibenzoate
| Molecular Formula | C28H30N2O6 |
|---|---|
| Molecular Weight | 490.21 g/mol |
| LogP | 4.4236 |
| Topological Polar Surface Area | 110.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 490.2104 |
| Heavy Atoms | 36 |
| Complexity | 1132.5507 |
Chemical Identifiers
| CAS Number | 313506-10-4 |
|---|---|
| SMILES | COC(=O)C1=CC(=CC=C1)NC(=O)C23CC4CC(C2)CC(C4)(C3)C(=O)NC5=CC=CC(=C5)C(=O)OC |
Product Overview
UPCMLD0ENAT5609870:001 (CAS 313506-10-4), with molecular formula C28H30N2O6 and molecular weight 490.21 g/mol. IUPAC: methyl 3-[[3-[(3-methoxycarbonylphenyl)carbamoyl]adamantane-1-carbonyl]amino]benzoate.
Chemical Property Profile of UPCMLD0ENAT5609870:001
Property Insights of UPCMLD0ENAT5609870:001
The XLogP value of 4.4236 indicates that UPCMLD0ENAT5609870:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.8 Ų falls within the moderate polarity range, balancing permeability and solubility for UPCMLD0ENAT5609870:001. Following Lipinski's Rule of Five, UPCMLD0ENAT5609870:001 has 2 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 UPCMLD0ENAT5609870:001?
The CAS number of UPCMLD0ENAT5609870:001 is 313506-10-4.
What is the molecular formula of UPCMLD0ENAT5609870:001?
The molecular formula of UPCMLD0ENAT5609870:001 is C28H30N2O6.
What is the molecular weight of UPCMLD0ENAT5609870:001?
The molecular weight of UPCMLD0ENAT5609870:001 is 490.21 g/mol.
Where can I buy UPCMLD0ENAT5609870:001?
You can request a quote for UPCMLD0ENAT5609870:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT5609870:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT5609870:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.