2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-
TL;DR: 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- (CAS 36995-90-1) is a chemical compound with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-6-(N-methylanilino)-1H-pyrimidine-2,4-dione
Also Known As: ChemDiv2_004991, 3-Methyl-6-(N-methylanilino)uracil, BAS 08330571, IDI1_003706, 3-methyl-6-(N-methylanilino)-1H-pyrimidine-2,4-dione
| Molecular Formula | C12H13N3O2 |
|---|---|
| Molecular Weight | 231.10 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 231.10077 |
| Heavy Atoms | 17 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 36995-90-1 |
|---|---|
| SMILES | CN1C(=O)C=C(NC1=O)N(C)C2=CC=CC=C2 |
| InChIKey | MBJXBYVPWYHBLY-UHFFFAOYSA-N |
Product Overview
2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- (CAS 36995-90-1), with molecular formula C12H13N3O2 and molecular weight 231.10 g/mol. IUPAC: 3-methyl-6-(N-methylanilino)-1H-pyrimidine-2,4-dione.
Chemical Property Profile of 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-
Property Insights of 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-. With a topological polar surface area (TPSA) of 52.7 Ų, 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- has 1 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 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-?
The CAS number of 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- is 36995-90-1.
What is the molecular formula of 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-?
The molecular formula of 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- is C12H13N3O2.
What is the molecular weight of 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-?
The molecular weight of 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- is 231.10 g/mol.
Where can I buy 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-?
You can request a quote for 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)-?
Yes, KEHONG BIO provides custom synthesis services for 2,4(1H,3H)-Pyrimidinedione, 3-methyl-6-(methylphenylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.