![CAS 199277-70-8 Pyridine, 2-[(4S)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]-6-methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/199277-70-8.gif)
CAS RN: 199277-70-8
Pyridine, 2-[(4S)-4,5-dihydro-4-(1-methylethyl)-2-oxazolyl]-6-methyl-
Product Availability
Choose a grade to view its available package options.
4 package records2 with current stock1 grade group
- Product code: SSC-093812
Historical Factory Record
Historical Supply Reference
This product has historical factory records. Recorded pack sizes and purity can be used as a supply reference, while project-specific availability is confirmed by inquiry.
- Pack sizes on record: 1g
- Available purity: ≥95%
- Inventory rows with stock: 0
- Bulk packaging: confirmed by inquiry
Reference Pack Sizes
Reference pack sizes are shown below. Final availability, packaging and delivery schedule are confirmed by inquiry.
| Pack Size | Recorded Purity | Available Qty | Ship From | Inquiry |
|---|---|---|---|---|
| 1g | ≥95% | 0 Out of Stock | Shanghai | Inquiry |
199277-70-8 / (4S)-2-(6-methyl-2-pyridinyl)-4-propan-2-yl-4,5-dihydro-1,3-oxazole
Basic Information
CAS
199277-70-8
Multi CAS
No
Molecular Formula
C12H16N2O
Molecular Weight
204.270000
Exact Mass
204.126263
SMILES
CC1=NC(=CC=C1)C2=N[C@H](CO2)C(C)C
InChI
InChI=1S/C12H16N2O/c1-8(2)11-7-15-12(14-11)10-6-4-5-9(3)13-10/h4-6,8,11H,7H2,1-3H3/t11-/m1/s1
InChIKey
VMSCZASBHFNABE-LLVKDONJSA-N
Computed Properties
Structural Parameters
Heavy atom count
15
Aromatic heavy atom count
6
Fraction Csp3
0.5
Rotatable bonds
2
H-bond acceptors
3
Molar refractivity
60.09
TPSA
34.48
LogP / Solubility
WLOGP
2.19
MLOGP
1.93
XLogP3
2.5
Consensus LogP
2.21
Log S (ESOL)
-2.65
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.82
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.05
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.41
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
2
Customers Also Viewed
-
![CAS 199277-73-1 Pyridine, 2-[(4R)-4,5-dihydro-4-phenyl-2-oxazolyl]-6-methyl- molecular structure](data:image/svg+xml,%3Csvg%20xmlns='http://www.w3.org/2000/svg'%20viewBox='0%200%200%200'%3E%3C/svg%3E)
Pyridine, 2-[(4R)-4,5-dihydro-4-phenyl-2-oxazolyl]-6-methyl-
- CAS RN: 199277-73-1
- Product Code: SSC-093813
-
Pyridine, 2-[(4S)-4,5-dihydro-4-(phenylmethyl)-2-oxazolyl]-6-methyl-
- CAS RN: 199277-77-5
- Product Code: SSC-093814
-
(S)-2-[4-(1,1-Dimethylethyl)-4,5-dihydro-2-oxazolyl]-6-methylpyridine
- CAS RN: 199277-80-0
- Product Code: SSC-093815
-
1-(2,3,4-TRIMETHOXYBENZYL)-1H-PYRAZOL-5-AMINE
- CAS RN: 199277-87-7
- Product Code: SSC-093816
-
-
![CAS 199277-73-1 Pyridine, 2-[(4R)-4,5-dihydro-4-phenyl-2-oxazolyl]-6-methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/199277-73-1.gif)
![CAS 199277-77-5 Pyridine, 2-[(4S)-4,5-dihydro-4-(phenylmethyl)-2-oxazolyl]-6-methyl- molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/199277-77-5.gif)
![CAS 199277-80-0 (S)-2-[4-(1,1-Dimethylethyl)-4,5-dihydro-2-oxazolyl]-6-methylpyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/199277-80-0.gif)
