CAS RN: 1093085-89-2
((2R,6S)-4-benzyl-6-(benzyloxyMethyl)Morpholin-2-yl)Methanol
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.20250120 | 100mg | Out of stock | 8-10 business days | Inquiry |
- Product code: starshine_CAS1093085-89-2
- Purity/Analytical Methods: >99.0%
1093085-89-2 / [(2R,6S)-4-benzyl-6-(phenylmethoxymethyl)morpholin-2-yl]methanol
6-[(Phenylmethoxy)methyl]-4-(phenylmethyl)-2-morpholinemethanol | [4-benzyl-6-(phenylmethoxymethyl)morpholin-2-yl]methanol | SCHEMBL11392608
Basic Information
CAS
1093085-89-2
Multi CAS
Yes
Molecular Formula
C20H25NO3
Molecular Weight
327.400000
Exact Mass
327.183444
SMILES
C1[C@@H](O[C@@H](CN1CC2=CC=CC=C2)COCC3=CC=CC=C3)CO
InChI
InChI=1S/C20H25NO3/c22-14-19-12-21(11-17-7-3-1-4-8-17)13-20(24-19)16-23-15-18-9-5-2-6-10-18/h1-10,19-20,22H,11-16H2/t19-,20+/m1/s1
InChIKey
FIXBPASWOSCPPO-UXHICEINSA-N
Synonyms
6-[(Phenylmethoxy)methyl]-4-(phenylmethyl)-2-morpholinemethanol
[4-benzyl-6-(phenylmethoxymethyl)morpholin-2-yl]methanol
SCHEMBL11392608
FIXBPASWOSCPPO-UHFFFAOYSA-N
[4-benzyl-6-(benzyloxymethyl)morpholin-2-yl]methanol
Computed Properties
Structural Parameters
Heavy atom count
24
Aromatic heavy atom count
12
Fraction Csp3
0.4
Rotatable bonds
7
H-bond acceptors
4
H-bond donors
1
Molar refractivity
93.56
TPSA
41.93
LogP / Solubility
WLOGP
2.47
MLOGP
2.18
XLogP3
2.2
Consensus LogP
2.28
Log S (ESOL)
-3.33
Class (ESOL)
Poorly soluble
Log S (Ali)
-4.02
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-4.67
Class (SILICOS-IT)
Slightly soluble
ADME
GI absorption
High
BBB permeant
Yes
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-2.97
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
Yes
Synthetic Accessibility
3.5
Customers Also Viewed
-
(2R,6S)-6-(benzyloxyMethyl)-4-(tert-butoxycarbonyl)Morpholine-2-carboxylic acid
- CAS RN: 1093085-91-6
- Product Code: starshine_CAS1093085-91-6
- Purity/Analytical method: >99.0%
-
-
-
8-Bromo-6-chloro-3-formylimidazo[1,2-a]pyridine
- CAS RN: 1093092-63-7
- Product Code: starshine_CAS1093092-63-7
- Purity/Analytical method: >99.0%
-
6-Bromo-[1,2,4)triazolo[4,3-a)pyridine-3-thiol
- CAS RN: 1093092-64-8
- Product Code: SSC-010567
-
B-Raf inhibitor 1
- CAS RN: 1093100-40-3
- Product Code: starshine_CAS1093100-40-3
- Purity/Analytical method: >99.0%
![CAS 1093092-63-7 8-Bromo-6-chloro-3-formylimidazo[1,2-a]pyridine molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1093092-63-7.gif)
