BAS 00329767
TL;DR: BAS 00329767 (CAS 311795-51-4) is a chemical compound with molecular formula C25H30N2O5 and molecular weight 438.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-[4-(dimethylamino)-3-nitrophenyl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
Also Known As: BAS 00329767, 9-{4-(dimethylamino)-3-nitrophenyl}-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione, A1563/0068109, 9-[4-(dimethylamino)-3-nitrophenyl]-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione, 9-[4-(dimethylamino)-3-nitrophenyl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione
| Molecular Formula | C25H30N2O5 |
|---|---|
| Molecular Weight | 438.22 g/mol |
| LogP | 5.061 |
| Topological Polar Surface Area | 89.75 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 438.21548 |
| Heavy Atoms | 32 |
| Complexity | 1055.3291 |
Chemical Identifiers
| CAS Number | 311795-51-4 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C4=CC(=C(C=C4)N(C)C)[N+](=O)[O-])C(=O)C1)C |
Product Overview
BAS 00329767 (CAS 311795-51-4), with molecular formula C25H30N2O5 and molecular weight 438.22 g/mol. IUPAC: 9-[4-(dimethylamino)-3-nitrophenyl]-3,3,6,6-tetramethyl-4,5,7,9-tetrahydro-2H-xanthene-1,8-dione.
Chemical Property Profile of BAS 00329767
Property Insights of BAS 00329767
The XLogP value of 5.061 indicates that BAS 00329767 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.75 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00329767. Following Lipinski's Rule of Five, BAS 00329767 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 00329767?
The CAS number of BAS 00329767 is 311795-51-4.
What is the molecular formula of BAS 00329767?
The molecular formula of BAS 00329767 is C25H30N2O5.
What is the molecular weight of BAS 00329767?
The molecular weight of BAS 00329767 is 438.22 g/mol.
Where can I buy BAS 00329767?
You can request a quote for BAS 00329767 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00329767?
Yes, KEHONG BIO provides custom synthesis services for BAS 00329767 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.