UPCMLD0ENAT0516-9355:001
TL;DR: UPCMLD0ENAT0516-9355:001 (CAS 1005060-70-7) is a chemical compound with molecular formula C23H27N3O3 and molecular weight 393.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-butyl-3-[4-(dimethylamino)phenyl]-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: UPCMLD0ENAT0516-9355:001, 5-butyl-3-(4-(dimethylamino)phenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-butyl-3-[4-(dimethylamino)phenyl]-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione, F1275-0010, 5-butyl-3-[4-(dimethylamino)phenyl]-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
| Molecular Formula | C23H27N3O3 |
|---|---|
| Molecular Weight | 393.21 g/mol |
| LogP | 3.3992 |
| Topological Polar Surface Area | 53.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.20523 |
| Heavy Atoms | 29 |
| Complexity | 882.0009 |
Chemical Identifiers
| CAS Number | 1005060-70-7 |
|---|---|
| SMILES | CCCCN1C(=O)C2C(N(OC2C1=O)C3=CC=CC=C3)C4=CC=C(C=C4)N(C)C |
Product Overview
UPCMLD0ENAT0516-9355:001 (CAS 1005060-70-7), with molecular formula C23H27N3O3 and molecular weight 393.21 g/mol. IUPAC: 5-butyl-3-[4-(dimethylamino)phenyl]-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of UPCMLD0ENAT0516-9355:001
Property Insights of UPCMLD0ENAT0516-9355:001
The XLogP value of 3.3992 indicates that UPCMLD0ENAT0516-9355:001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.09 Ų, UPCMLD0ENAT0516-9355:001 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, UPCMLD0ENAT0516-9355:001 has 0 hydrogen bond donor(s) and 5 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 UPCMLD0ENAT0516-9355:001?
The CAS number of UPCMLD0ENAT0516-9355:001 is 1005060-70-7.
What is the molecular formula of UPCMLD0ENAT0516-9355:001?
The molecular formula of UPCMLD0ENAT0516-9355:001 is C23H27N3O3.
What is the molecular weight of UPCMLD0ENAT0516-9355:001?
The molecular weight of UPCMLD0ENAT0516-9355:001 is 393.21 g/mol.
Where can I buy UPCMLD0ENAT0516-9355:001?
You can request a quote for UPCMLD0ENAT0516-9355:001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for UPCMLD0ENAT0516-9355:001?
Yes, KEHONG BIO provides custom synthesis services for UPCMLD0ENAT0516-9355:001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.