ChemDiv3_003982
TL;DR: ChemDiv3_003982 (CAS 307550-51-2) is a chemical compound with molecular formula C18H21NO4 and molecular weight 315.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethyl-2-[(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl)oxy]acetamide
Also Known As: ChemDiv3_003982, BAS 02236227, IDI1_021892, BRD-K33725770-001-01-4, N,N-dimethyl-2-[(3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl)oxy]acetamide
| Molecular Formula | C18H21NO4 |
|---|---|
| Molecular Weight | 315.15 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 315.14706 |
| Heavy Atoms | 23 |
| Complexity | 525.0 |
Chemical Identifiers
| CAS Number | 307550-51-2 |
|---|---|
| SMILES | CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1)OCC(=O)N(C)C |
| InChIKey | UNVQWUVGBYFYHQ-UHFFFAOYSA-N |
Product Overview
ChemDiv3_003982 (CAS 307550-51-2), with molecular formula C18H21NO4 and molecular weight 315.15 g/mol. IUPAC: N,N-dimethyl-2-[(3-methyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-1-yl)oxy]acetamide.
Chemical Property Profile of ChemDiv3_003982
Property Insights of ChemDiv3_003982
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv3_003982. With a topological polar surface area (TPSA) of 55.8 Ų, ChemDiv3_003982 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_003982 has 0 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 ChemDiv3_003982?
The CAS number of ChemDiv3_003982 is 307550-51-2.
What is the molecular formula of ChemDiv3_003982?
The molecular formula of ChemDiv3_003982 is C18H21NO4.
What is the molecular weight of ChemDiv3_003982?
The molecular weight of ChemDiv3_003982 is 315.15 g/mol.
Where can I buy ChemDiv3_003982?
You can request a quote for ChemDiv3_003982 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_003982?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_003982 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.