![CAS 63671-68-1 2-{[(pyridin-2-ylmethyl)amino]methyl}phenol molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/63671-68-1.gif)
CAS RN: 63671-68-1
2-{[(pyridin-2-ylmethyl)amino]methyl}phenol
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250928 | 5mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS63671-68-1
- Purity/Analytical Methods: >99.0%
63671-68-1 / 2-[(pyridin-2-ylmethylamino)methyl]phenol
Basic Information
CAS
63671-68-1
Multi CAS
No
Molecular Formula
C13H14N2O
Molecular Weight
214.260000
Exact Mass
214.110613
InChI
InChI=1S/C13H14N2O/c16-13-7-2-1-5-11(13)9-14-10-12-6-3-4-8-15-12/h1-8,14,16H,9-10H2
InChIKey
QKSKEROUBXANPB-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
16
Aromatic heavy atom count
12
Fraction Csp3
0.15
Rotatable bonds
4
H-bond acceptors
3
H-bond donors
2
Molar refractivity
62.89
TPSA
45.15
LogP / Solubility
WLOGP
2.08
MLOGP
1.83
XLogP3
1.9
Consensus LogP
1.94
Log S (ESOL)
-2.77
Class (ESOL)
Moderately soluble
Log S (Ali)
-2.82
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-3.26
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
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.55
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
No
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
PAINS alerts
1
Leadlikeness
No
Synthetic Accessibility
1.5
Customers Also Viewed
-
1-(2,6-DIMETHYLPHENYL)-5-OXOPYRROLIDINE-3-CARBOXYLIC ACID
- CAS RN: 63674-48-6
- Product Code: SSC-173400
-
1-[3-(METHYLTHIO)PHENYL]-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID
- CAS RN: 63674-52-2
- Product Code: starshine_CAS63674-52-2
- Purity/Analytical method: >99.0%
-
1-(3,5-DIMETHYLPHENYL)-5-OXOPYRROLIDINE-3-CARBOXYLIC ACID
- CAS RN: 63674-63-5
- Product Code: SSC-173401
-
1-(3-CHLORO-4-METHYLPHENYL)-5-OXOPYRROLIDINE-3-CARBOXYLIC ACID
- CAS RN: 63674-66-8
- Product Code: SSC-173402
-
1-(2-ETHYLPHENYL)-5-OXOPYRROLIDINE-3-CARBOXYLIC ACID
- CAS RN: 63675-17-2
- Product Code: starshine_CAS63675-17-2
- Purity/Analytical method: >99.0%
-
![CAS 63674-52-2 1-[3-(METHYLTHIO)PHENYL]-5-OXO-PYRROLIDINE-3-CARBOXYLIC ACID molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/63674-52-2.gif)
