CAS RN: 1133424-00-6
Meropenem-d6
Product Availability
Choose a grade to view its available package options.
1 package records1 with current stock1 grade group
| Batch No. | Package | Availability | Warehouse | Inquiry |
|---|---|---|---|---|
| Batchno.20260425 | 1mg | In stock | Shanghai | Inquiry |
- Product code: starshine_CAS1133424-00-6
- Purity/Analytical Methods: >99.0%
1133424-00-6 / (4R,5S,6S)-3-[(3S,5S)-5-[bis(trideuteriomethyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Meropenem-d6 | Meropenem-d6-1 | (4R,5S,6S)-3-[(3S,5S)-5-[bis(trideuteriomethyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Basic Information
CAS
1133424-00-6
Multi CAS
No
Molecular Formula
C17H25N3O5S
Molecular Weight
389.500000
Exact Mass
389.189153
SMILES
[2H]C([2H])([2H])N(C(=O)[C@@H]1C[C@@H](CN1)SC2=C(N3[C@H]([C@H]2C)[C@H](C3=O)[C@@H](C)O)C(=O)O)C([2H])([2H])[2H]
InChI
InChI=1S/C17H25N3O5S/c1-7-12-11(8(2)21)16(23)20(12)13(17(24)25)14(7)26-9-5-10(18-6-9)15(22)19(3)4/h7-12,18,21H,5-6H2,1-4H3,(H,24,25)/t7-,8-,9+,10+,11-,12-/m1/s1/i3D3,4D3
InChIKey
DMJNNHOOLUXYBV-ZSJYILIPSA-N
Synonyms
Meropenem-d6
Meropenem-d6-1
(4R,5S,6S)-3-[(3S,5S)-5-[bis(trideuteriomethyl)carbamoyl]pyrrolidin-3-yl]sulfanyl-6-[(1R)-1-hydroxyethyl]-4-methyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid
Meropenem-d6 (>90%)
Meropenem D6
Computed Properties
Structural Parameters
Heavy atom count
26
Fraction Csp3
0.71
Rotatable bonds
5
H-bond acceptors
6
H-bond donors
3
Molar refractivity
96.11
TPSA
110.18
LogP / Solubility
WLOGP
-0.31
MLOGP
-0.25
XLogP3
-2.4
Consensus LogP
-0.99
Log S (ESOL)
-1.69
Class (ESOL)
Soluble
Log S (Ali)
-2.48
Class (Ali)
Moderately soluble
Log S (SILICOS-IT)
-2.5
Class (SILICOS-IT)
Moderately soluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
No
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-5.28
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
Yes
Egan
Yes
Muegge
Yes
Bioavailability score
0.55
Leadlikeness
No
Synthetic Accessibility
5.5
Customers Also Viewed
-
CGP-72670-d4
- CAS RN: 1133425-75-8
- Product Code: starshine_CAS1133425-75-8
- Purity/Analytical method: >99.0%
-
GDC0834
- CAS RN: 1133432-49-1
- Product Code: starshine_CAS1133432-49-1
- Purity/Analytical method: >99.0%
-
Bortezomib-d5
- CAS RN: 1133706-15-6
- Product Code: starshine_CAS1133706-15-6
- Purity/Analytical method: >99.0%
-
5-(4-(2-(3-METHOXYPHENYL)-2-OXOETHOXY)BENZYL)THIAZOLIDINE-2,4-DIONE
- CAS RN: 1133819-87-0
- Product Code: starshine_CAS1133819-87-0
- Purity/Analytical method: >99.0%
-
N-[(1S,2S)-2-(diMethylaMino)cyclohexyl]-N’-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-Thiourea
- CAS RN: 1133834-54-4
- Product Code: starshine_CAS1133834-54-4
- Purity/Analytical method: >99.0%
-
![CAS 1133834-54-4 N-[(1S,2S)-2-(diMethylaMino)cyclohexyl]-N’-(2,3,4,6-tetra-O-acetyl-β-D-glucopyranosyl)-Thiourea molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/1133834-54-4.gif)
