MixCom6_001641
TL;DR: MixCom6_001641 (CAS 6077-41-4) is a chemical compound with molecular formula C24H19N3O5 and molecular weight 429.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-benzyl-3-(3-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
Also Known As: MixCom6_001641, BAS 00917995, BIM-0031080.P001, 5-benzyl-3-(3-nitrophenyl)-2-phenyldihydro-2H-pyrrolo[3,4-d]isoxazole-4,6(5H,6aH)-dione, 5-benzyl-3-(3-nitrophenyl)-2-phenyl-hexahydro-2H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione
| Molecular Formula | C24H19N3O5 |
|---|---|
| Molecular Weight | 429.13 g/mol |
| LogP | 3.6415 |
| Topological Polar Surface Area | 92.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 429.13248 |
| Heavy Atoms | 32 |
| Complexity | 1184.5087 |
Chemical Identifiers
| CAS Number | 6077-41-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)CN2C(=O)C3C(N(OC3C2=O)C4=CC=CC=C4)C5=CC(=CC=C5)[N+](=O)[O-] |
Product Overview
MixCom6_001641 (CAS 6077-41-4), with molecular formula C24H19N3O5 and molecular weight 429.13 g/mol. IUPAC: 5-benzyl-3-(3-nitrophenyl)-2-phenyl-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazole-4,6-dione.
Chemical Property Profile of MixCom6_001641
Property Insights of MixCom6_001641
The XLogP value of 3.6415 indicates that MixCom6_001641 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.99 Ų falls within the moderate polarity range, balancing permeability and solubility for MixCom6_001641. Following Lipinski's Rule of Five, MixCom6_001641 has 0 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 MixCom6_001641?
The CAS number of MixCom6_001641 is 6077-41-4.
What is the molecular formula of MixCom6_001641?
The molecular formula of MixCom6_001641 is C24H19N3O5.
What is the molecular weight of MixCom6_001641?
The molecular weight of MixCom6_001641 is 429.13 g/mol.
Where can I buy MixCom6_001641?
You can request a quote for MixCom6_001641 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for MixCom6_001641?
Yes, KEHONG BIO provides custom synthesis services for MixCom6_001641 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.