![5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione structure](/static/products/902/902325-34-2.png)
5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione
TL;DR: 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione (CAS 902325-34-2) is a chemical compound with molecular formula C23H29N3O3 and molecular weight 395.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(4-tert-butylphenyl)-3,5,10,10-tetramethyl-12-oxa-3,5,9-triazatricyclo[7.4.0.02,7]trideca-1,7-diene-4,6-dione
Also Known As: 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione, 5-(4-tert-butylphenyl)-1,3,7,7-tetramethyl-1,7,8,10-tetrahydro-2H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H)-dione
| Molecular Formula | C23H29N3O3 |
|---|---|
| Molecular Weight | 395.22 g/mol |
| LogP | 3.2685 |
| Topological Polar Surface Area | 58.16 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 395.2209 |
| Heavy Atoms | 29 |
| Complexity | 1232.3196 |
Chemical Identifiers
| CAS Number | 902325-34-2 |
|---|---|
| SMILES | CC1(COCC2=C3C(=C(N21)C4=CC=C(C=C4)C(C)(C)C)C(=O)N(C(=O)N3C)C)C |
Product Overview
5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione (CAS 902325-34-2), with molecular formula C23H29N3O3 and molecular weight 395.22 g/mol. IUPAC: 8-(4-tert-butylphenyl)-3,5,10,10-tetramethyl-12-oxa-3,5,9-triazatricyclo[7.4.0.02,7]trideca-1,7-diene-4,6-dione.
Chemical Property Profile of 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione
Property Insights of 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione
The XLogP value of 3.2685 indicates that 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.16 Ų, 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione has 0 hydrogen bond donor(s) and 3 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 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione?
The CAS number of 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione is 902325-34-2.
What is the molecular formula of 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione?
The molecular formula of 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione is C23H29N3O3.
What is the molecular weight of 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione?
The molecular weight of 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione is 395.22 g/mol.
Where can I buy 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione?
You can request a quote for 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-(4-(tert-butyl)phenyl)-1,3,7,7-tetramethyl-7,8-dihydro-1H-pyrimido[4',5':3,4]pyrrolo[2,1-c][1,4]oxazine-2,4(3H,10H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.