![CAS 97484-73-6 1-benzyl-1H-pyrido[2,3-d][1,3]oxazine-2,4-dione molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/97484-73-6.gif)
CAS RN: 97484-73-6
1-benzyl-1H-pyrido[2,3-d][1,3]oxazine-2,4-dione
- Product code: SSC-212303
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: 5g
- 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 |
|---|---|---|---|---|
| 5g | ≥95% | 0 Out of Stock | Hong Kong | Inquiry |
97484-73-6 / 1-benzylpyrido[2,3-d][1,3]oxazine-2,4-dione
Basic Information
CAS
97484-73-6
Multi CAS
Yes
Molecular Formula
C14H10N2O3
Molecular Weight
254.240000
Exact Mass
254.069142
InChI
InChI=1S/C14H10N2O3/c17-13-11-7-4-8-15-12(11)16(14(18)19-13)9-10-5-2-1-3-6-10/h1-8H,9H2
InChIKey
IOTFENHDTBFXDO-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
16
Fraction Csp3
0.07
Rotatable bonds
2
H-bond acceptors
5
Molar refractivity
70.08
TPSA
65.1
LogP / Solubility
WLOGP
1.4
MLOGP
1.24
XLogP3
2
Consensus LogP
1.55
Log S (ESOL)
-2.79
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.65
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.71
Class (SILICOS-IT)
Moderately 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)
-3.28
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
1.5
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