CAS RN: 277313-08-3
2-Hydroxy-N-Methoxy-N-Methyl-[1,1-Biphenyl]-3-Carboxamide(WXC01955)
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1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
| Batchno.20250717 |
100mg / 250mg |
Out of stock |
5-7 business days | Inquiry |
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Product code:
starshine_CAS277313-08-3
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Purity/Analytical Methods:
>99.0%
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277313-08-3 / 2-hydroxy-N-methoxy-N-methyl-3-phenylbenzamide
Standard CAS: 277313-08-3
Multi CAS: No
Basic Information
CAS
277313-08-3
Multi CAS
No
Molecular Formula
C15H15NO3
Molecular Weight
257.280000
Exact Mass
257.105193
InChI
InChI=1S/C15H15NO3/c1-16(19-2)15(18)13-10-6-9-12(14(13)17)11-7-4-3-5-8-11/h3-10,17H,1-2H3
InChIKey
WAJUEAMTSOPIKH-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
19
Aromatic heavy atom count
12
Fraction Csp3
0.13
Rotatable bonds
3
H-bond acceptors
3
H-bond donors
1
Molar refractivity
72.65
TPSA
49.77
LogP / Solubility
WLOGP
2.69
MLOGP
2.38
XLogP3
3.3
Consensus LogP
2.79
Log S (ESOL)
-3.4
Class (ESOL)
Poorly soluble
Log S (Ali)
-3.61
Class (Ali)
Poorly soluble
Log S (SILICOS-IT)
-3.93
Class (SILICOS-IT)
Poorly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.38
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
Yes
Synthetic Accessibility
1.5