기본 정보
- CAS
155814-26-9- 표준 SMILES
CCCn1c(=O)c2c(nc(/C=C/c3ccc(OCOC)c(OCOC)c3)n2C)n(CCC)c1=O- InChIKey
DXBWGAGBXVYUFM-PKNBQFBNSA-N- 분자식
- C24H32N4O6
- 평균 분자량
- 472.5 g/mol
- 단동위원소 질량
- 472.23218475
이름 및 식별자
- 우선 이름
- 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(3,4-bis(methoxymethoxy)phenyl)ethenyl)-1,3-dipropyl-7-methyl-, (E)-
- IUPAC
- 8-[(E)-2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione
- 영어명
- 1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(3,4-bis(methoxymethoxy)phenyl)e thenyl)-1,3-dipropyl-7-methyl-, (E)-
- 분자식
- C24H32N4O6
- 분자량
- 472.53
이름 및 동의어
155814-26-91H-Purine-2,6-dione, 3,7-dihydro-8-(2-(3,4-bis(methoxymethoxy)phenyl)ethenyl)-1,3-dipropyl-7-methyl-, (E)-RefChem:1058409(E)-8-(3,4-Bis(methoxymethoxy)styryl)-7-methyl-1,3-dipropylxanthine(E)-8-[3,4-Bis(methoxymethoxy)styryl]-7-methyl-1,3-dipropylxanthineDXBWGAGBXVYUFM-PKNBQFBNSA-N8-[(E)-2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dioneSCHEMBL77309221H-Purine-2,6-dione, 3,7-dihydro-8-(2-(3,4-bis(methoxymethoxy)phenyl)e thenyl)-1,3-dipropyl-7-methyl1H-Purine-2,6-dione, 3,7-dihydro-8-(2-(3,4-bis(methoxymethoxy)phenyl)e thenyl)-1,3-dipropyl-7-methyl-, (E)-1H-Purine-2,6-dione, 8-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]-3,7-dihydro-7-methyl-1,3-dipropyl-, (E)- (9CI)
데이터베이스 식별자
- CAS
155814-26-9- PubChem CID
- 6448971
물성
구조 계산 물성
- XLogP
- 3.5
- 극성 표면적
- 95.4 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 7
- 회전 가능 결합 수
- 12
- 무거운 원자 수
- 34
- 형식 전하
- 0
- 복잡도
- 707
화학 및 산업
공급사1 곳
HONEST JOY HOLDINGS LIMITED[email protected]
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