![10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione structure](/static/products/895/895849-59-9.png)
10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
TL;DR: 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione (CAS 895849-59-9) is a chemical compound with molecular formula C25H24N4O6 and molecular weight 476.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-(4-hydroxyphenyl)-3,5,10,10-tetramethyl-8-(3-nitrophenyl)-12-oxa-3,5,9-triazatricyclo[7.4.0.02,7]trideca-1,7-diene-4,6-dione
Also Known As: 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione, 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione
| Molecular Formula | C25H24N4O6 |
|---|---|
| Molecular Weight | 476.17 g/mol |
| LogP | 3.1742 |
| Topological Polar Surface Area | 121.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 476.1696 |
| Heavy Atoms | 35 |
| Complexity | 1625.1973 |
Chemical Identifiers
| CAS Number | 895849-59-9 |
|---|---|
| SMILES | CC1(COC(C2=C3C(=C(N21)C4=CC(=CC=C4)[N+](=O)[O-])C(=O)N(C(=O)N3C)C)C5=CC=C(C=C5)O)C |
Product Overview
10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione (CAS 895849-59-9), with molecular formula C25H24N4O6 and molecular weight 476.17 g/mol. IUPAC: 13-(4-hydroxyphenyl)-3,5,10,10-tetramethyl-8-(3-nitrophenyl)-12-oxa-3,5,9-triazatricyclo[7.4.0.02,7]trideca-1,7-diene-4,6-dione.
Chemical Property Profile of 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
Property Insights of 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
The XLogP value of 3.1742 indicates that 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione. Following Lipinski's Rule of Five, 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione has 1 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 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione?
The CAS number of 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione is 895849-59-9.
What is the molecular formula of 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione?
The molecular formula of 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione is C25H24N4O6.
What is the molecular weight of 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione?
The molecular weight of 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione is 476.17 g/mol.
Where can I buy 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione?
You can request a quote for 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 10-(4-hydroxyphenyl)-1,3,7,7-tetramethyl-5-(3-nitrophenyl)-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.