CS-1001660
5-Methyl hydrogen N-[4-[1-[(2,4-diamino-6-pteridinyl)methyl]-3-butyn-1-yl]benzoyl]-L-glutamate
Manufacturer: ChemScene
CAS Number: 1548618-62-7
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Purity
98%
MDL No
None
Storage
Sealed in dry,2-8℃
Shipping
Room temperature in continental US; may vary elsewhere.
Molecular Formula
C₂₄H₂₅N₇O₅
Molecular Weight
491.50
Synonyms
None
SMILES
NC=1C2=C(N=CC(CC(CC#C)C3=CC=C(C(N[C@@H](CCC(OC)=O)C(O)=O)=O)C=C3)=N2)N=C(N)N1
Tpsa
196.3
Logp
1.07
H Acceptors
10
H Donors
4
Rotatable Bonds
10
Other Options
| Image | Product Name | Manufacturer | Price Range | |
|---|---|---|---|---|
 | 1548618-62-7 | Methyl Pralatrexate | A2B Chem | -- |
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SAFETY INFORMATION
ghsPictogramUrl
https://dev-s3.chemscene.com/web-image/physicalization/irritant.svg
Pictograms
Signal Word
Warning
UN Number
N/A
Class
N/A
Packing Group
N/A
Hazard Statements
Precautionary Statements
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501
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Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₂₄H₂₅N₇O₅
Molecular Weight: 491.50
Synonyms: None
SMILES: NC=1C2=C(N=CC(CC(CC#C)C3=CC=C(C(N[C@@H](CCC(OC)=O)C(O)=O)=O)C=C3)=N2)N=C(N)N1
Tpsa: 196.3
Logp: 1.07
H Acceptors: 10
H Donors: 4
Rotatable Bonds: 10
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₂₄H₂₅N₇O₅
Molecular Weight:
491.50
Synonyms:
None
SMILES:
NC=1C2=C(N=CC(CC(CC#C)C3=CC=C(C(N[C@@H](CCC(OC)=O)C(O)=O)=O)C=C3)=N2)N=C(N)N1
Tpsa:
196.3
Logp:
1.07
H Acceptors:
10
H Donors:
4
Rotatable Bonds:
10
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₂H₁₅NO₃
Molecular Weight: 221.25
Synonyms: None
SMILES: C(NC=O)[C@@H]1C=2C(C1)=CC(OC)=C(OC)C2
Tpsa: 47.56
Logp: 1.0895
H Acceptors: 3
H Donors: 1
Rotatable Bonds: 5
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₂H₁₅NO₃
Molecular Weight:
221.25
Synonyms:
None
SMILES:
C(NC=O)[C@@H]1C=2C(C1)=CC(OC)=C(OC)C2
Tpsa:
47.56
Logp:
1.0895
H Acceptors:
3
H Donors:
1
Rotatable Bonds:
5
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₇H₂₅N₃O₂
Molecular Weight: 303.40
Synonyms: None
SMILES: C(C=1C=C(OC/C=C\CNC(C)=O)N=CC1)N2CCCCC2
Tpsa: 54.46
Logp: 2.1386
H Acceptors: 4
H Donors: 1
Rotatable Bonds: 7
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₇H₂₅N₃O₂
Molecular Weight:
303.40
Synonyms:
None
SMILES:
C(C=1C=C(OC/C=C\CNC(C)=O)N=CC1)N2CCCCC2
Tpsa:
54.46
Logp:
2.1386
H Acceptors:
4
H Donors:
1
Rotatable Bonds:
7
Purity: 98%
MDL No: None
Storage: Sealed in dry,2-8℃
Shipping: Room temperature in continental US; may vary elsewhere.
Molecular Formula: C₁₀H₁₂N₂
Molecular Weight: 160.22
Synonyms: None
SMILES: N#CC(C1=CC=C(N)C=C1)CC
Tpsa: 49.81
Logp: 2.28598
H Acceptors: 2
H Donors: 1
Rotatable Bonds: 2
Purity:
98%
MDL No:
None
Storage:
Sealed in dry,2-8℃
Shipping:
Room temperature in continental US; may vary elsewhere.
Molecular Formula:
C₁₀H₁₂N₂
Molecular Weight:
160.22
Synonyms:
None
SMILES:
N#CC(C1=CC=C(N)C=C1)CC
Tpsa:
49.81
Logp:
2.28598
H Acceptors:
2
H Donors:
1
Rotatable Bonds:
2