CAS RN: 1622849-58-4
GSK481
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13 package records9 with current stock3 grade groups
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250926 | 1ml | In stock | Inquiry |
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20250830 | 100mg | Out of stock | Inquiry | |
| Batchno.20260607 | 10mg | In stock | Shanghai | Inquiry |
| Batchno.20251013 | 1mg | In stock | Shanghai | Inquiry |
| Batchno.20251120 | 25mg | Out of stock | Inquiry | |
| Batchno.20250507 | 2mg | In stock | Shanghai | Inquiry |
| Batchno.20250227 | 50mg | Out of stock | Inquiry | |
| Batchno.20250720 | 5mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1622849-58-4
- Purity/Analytical Methods: >99.0%
1622849-58-4 / 5-benzyl-N-[(3S)-5-methyl-4-oxo-2,3-dihydro-1,5-benzoxazepin-3-yl]-1,2-oxazole-3-carboxamide
Basic Information
CAS
1622849-58-4
Multi CAS
No
Molecular Formula
C21H19N3O4
Molecular Weight
377.400000
Exact Mass
377.137556
SMILES
CN1C2=CC=CC=C2OC[C@@H](C1=O)NC(=O)C3=NOC(=C3)CC4=CC=CC=C4
InChI
InChI=1S/C21H19N3O4/c1-24-18-9-5-6-10-19(18)27-13-17(21(24)26)22-20(25)16-12-15(28-23-16)11-14-7-3-2-4-8-14/h2-10,12,17H,11,13H2,1H3,(H,22,25)/t17-/m0/s1
InChIKey
KNOUWGGQMADIBV-KRWDZBQOSA-N
Computed Properties
Structural Parameters
Heavy atom count
28
Aromatic heavy atom count
17
Fraction Csp3
0.19
Rotatable bonds
4
H-bond acceptors
5
H-bond donors
1
Molar refractivity
102.35
TPSA
84.67
LogP / Solubility
WLOGP
2.42
MLOGP
2.15
XLogP3
2.8
Consensus LogP
2.46
Log S (ESOL)
-3.89
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.4
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.6
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-3.3
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
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