CAS RN: 215178-44-2
FMOC-L-PHENYLGLYCINOL
Product Availability
Choose a grade to view its available package options.
2 package records2 with current stock1 grade group
- Product code: starshine_CAS215178-44-2
- Purity/Analytical Methods: >99.0%
215178-44-2 / 9H-fluoren-9-ylmethyl N-[(1S)-2-hydroxy-1-phenylethyl]carbamate
Basic Information
CAS
215178-44-2
Multi CAS
No
Molecular Formula
C23H21NO3
Molecular Weight
359.400000
Exact Mass
359.152144
SMILES
C1=CC=C(C=C1)[C@@H](CO)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChI
InChI=1S/C23H21NO3/c25-14-22(16-8-2-1-3-9-16)24-23(26)27-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13,21-22,25H,14-15H2,(H,24,26)/t22-/m1/s1
InChIKey
CATSPGUSOQBNRU-JOCHJYFZSA-N
Computed Properties
Structural Parameters
Heavy atom count
27
Aromatic heavy atom count
18
Fraction Csp3
0.17
Rotatable bonds
5
H-bond acceptors
3
H-bond donors
2
Molar refractivity
104.47
TPSA
58.56
LogP / Solubility
WLOGP
4.26
MLOGP
3.77
XLogP3
3.9
Consensus LogP
3.98
Log S (ESOL)
-4.91
Class (ESOL)
Slightly soluble
Log S (Ali)
-5.58
Class (Ali)
Slightly soluble
Log S (SILICOS-IT)
-6.13
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
Yes
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.89
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
3.5
Customers Also Viewed
-
N-(9-FLUORENYLMETHOXYCARBONYL)-D-PROLIN&
- CAS RN: 215178-45-3
- Product Code: starshine_CAS215178-45-3
- Purity/Analytical method: >99.0%
-
-
1-Azido-2-(2-(2-ethoxyethoxy)ethoxy)ethane >=95%
- CAS RN: 215181-72-9
- Product Code: starshine_CAS215181-72-9
- Purity/Analytical method: >99.0%
-
TERT-BUTYL N-[(5-BROMO-2-THIENYL)METHYL]CARBAMATE
- CAS RN: 215183-27-0
- Product Code: SSC-103119
-
5-BROMO-3,4-DIHYDRO-1H-ISOQUINOLINE-2-CARBOXYLIC ACID TERT-BUTYL ESTER
- CAS RN: 215184-78-4
- Product Code: SSC-103122
-
![CAS 215183-27-0 TERT-BUTYL N-[(5-BROMO-2-THIENYL)METHYL]CARBAMATE molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/215183-27-0.gif)
