Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-
TL;DR: Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- (CAS 58323-00-5) is a chemical compound with molecular formula C19H27ClN2O3 and molecular weight 366.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4S,4aS,9bR)-8,9b-dimethyl-3-oxo-1,2,4,4a-tetrahydrodibenzofuran-4-yl]-3-(dimethylamino)propanamide;hydrochloride
Also Known As: Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-, 3-(Dimethylamino)-N-(8,9b-dimethyl-3-oxo-1,2,3,4,4a,9b-hexahydrodibenzo[b,d]furan-4-yl)propanimidic acid--hydrogen chloride (1/1), 3-(Dimethylamino)-N-[(4S,4aS,9bR)-8,9b-dimethyl-3-oxo-1,2,3,4,4a,9b-hexahydrodibenzo[b,d]furan-4-yl]propanimidic acid--hydrogen chloride (1/1), N-[(4S,4aS,9bR)-8,9b-dimethyl-3-oxo-1,2,4,4a-tetrahydrodibenzofuran-4-yl]-3-(dimethylamino)propanamide hydrochloride, RefChem:374071
| Molecular Formula | C19H27ClN2O3 |
|---|---|
| Molecular Weight | 366.17 g/mol |
| LogP | 2.23492 |
| Topological Polar Surface Area | 58.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 366.17102 |
| Heavy Atoms | 25 |
| Complexity | 676.6331 |
Chemical Identifiers
| CAS Number | 58323-00-5 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)O[C@H]3[C@@]2(CCC(=O)[C@H]3NC(=O)CCN(C)C)C.Cl |
Product Overview
Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- (CAS 58323-00-5), with molecular formula C19H27ClN2O3 and molecular weight 366.17 g/mol. IUPAC: N-[(4S,4aS,9bR)-8,9b-dimethyl-3-oxo-1,2,4,4a-tetrahydrodibenzofuran-4-yl]-3-(dimethylamino)propanamide;hydrochloride.
Chemical Property Profile of Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-
Property Insights of Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-
The XLogP value of 2.23492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-. With a topological polar surface area (TPSA) of 58.64 Ų, Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- has 1 hydrogen bond donor(s) and 4 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 Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-?
The CAS number of Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- is 58323-00-5.
What is the molecular formula of Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-?
The molecular formula of Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- is C19H27ClN2O3.
What is the molecular weight of Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-?
The molecular weight of Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- is 366.17 g/mol.
Where can I buy Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-?
You can request a quote for Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)-?
Yes, KEHONG BIO provides custom synthesis services for Propanamide, 3-(dimethylamino)-N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-benzofuranyl)-, monohydrochloride, (4-alpha,4a-beta,9b-beta)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.