![(3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one structure](/static/products/155/155392-17-9.png)
(3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one
TL;DR: (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one (CAS 155392-17-9) is a chemical compound with molecular formula C20H22N2O2 and molecular weight 322.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one
Also Known As: (S)-3-[(6-Isopropylbenzoxazol-2-yl)amino]-4-phenyl-2-butanone, 3-((6-isopropylbenzo[d]oxazol-2-yl)amino)-4-phenylbutan-2-one, (3S)-4-phenyl-3-[(6-propan-2-ylbenzooxazol-2-yl)amino]butan-2-one, (3S)-4-phenyl-3-{[6-(propan-2-yl)-1,3-benzoxazol-2-yl]amino}butan-2-one
| Molecular Formula | C20H22N2O2 |
|---|---|
| Molecular Weight | 322.17 g/mol |
| LogP | 4.5634 |
| Topological Polar Surface Area | 55.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.16812 |
| Heavy Atoms | 24 |
| Complexity | 837.22595 |
Chemical Identifiers
| CAS Number | 155392-17-9 |
|---|---|
| SMILES | CC(C)C1=CC2=C(C=C1)N=C(O2)N[C@@H](CC3=CC=CC=C3)C(=O)C |
Product Overview
(3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one (CAS 155392-17-9), with molecular formula C20H22N2O2 and molecular weight 322.17 g/mol. IUPAC: (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one.
Chemical Property Profile of (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one
Property Insights of (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one
The XLogP value of 4.5634 indicates that (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.13 Ų, (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one 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 (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one?
The CAS number of (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one is 155392-17-9.
What is the molecular formula of (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one?
The molecular formula of (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one is C20H22N2O2.
What is the molecular weight of (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one?
The molecular weight of (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one is 322.17 g/mol.
Where can I buy (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one?
You can request a quote for (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one?
Yes, KEHONG BIO provides custom synthesis services for (3S)-4-phenyl-3-[(6-propan-2-yl-1,3-benzoxazol-2-yl)amino]butan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.