BAS 00381637
TL;DR: BAS 00381637 (CAS 329062-31-9) is a chemical compound with molecular formula C20H29N3O3S and molecular weight 391.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethoxyethyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate
Also Known As: BAS 00381637, 2-Ethoxyethyl 4-(4-(diethylamino)phenyl)-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2-ethoxyethyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate, 2-ethoxyethyl 4-[4-(diethylamino)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate, 2-(ethyloxy)ethyl 4-[4-(diethylamino)phenyl]-6-methyl-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carboxylate
| Molecular Formula | C20H29N3O3S |
|---|---|
| Molecular Weight | 391.19 g/mol |
| LogP | 2.9053 |
| Topological Polar Surface Area | 62.83 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 391.19296 |
| Heavy Atoms | 27 |
| Complexity | 684.2173 |
Chemical Identifiers
| CAS Number | 329062-31-9 |
|---|---|
| SMILES | CCN(CC)C1=CC=C(C=C1)C2C(=C(NC(=S)N2)C)C(=O)OCCOCC |
Product Overview
BAS 00381637 (CAS 329062-31-9), with molecular formula C20H29N3O3S and molecular weight 391.19 g/mol. IUPAC: 2-ethoxyethyl 4-[4-(diethylamino)phenyl]-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate.
Chemical Property Profile of BAS 00381637
Property Insights of BAS 00381637
The XLogP value of 2.9053 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 00381637. The TPSA of 62.83 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00381637. Following Lipinski's Rule of Five, BAS 00381637 has 2 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 BAS 00381637?
The CAS number of BAS 00381637 is 329062-31-9.
What is the molecular formula of BAS 00381637?
The molecular formula of BAS 00381637 is C20H29N3O3S.
What is the molecular weight of BAS 00381637?
The molecular weight of BAS 00381637 is 391.19 g/mol.
Where can I buy BAS 00381637?
You can request a quote for BAS 00381637 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00381637?
Yes, KEHONG BIO provides custom synthesis services for BAS 00381637 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.